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- PDB-6e3b: STRUCTURE OF Siw14 CATALYTIC CORE -

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Basic information

Entry
Database: PDB / ID: 6e3b
TitleSTRUCTURE OF Siw14 CATALYTIC CORE
ComponentsTyrosine-protein phosphatase SIW14
KeywordsHYDROLASE / dual specificity phosphatase / inositol phosphate / VH1-like phosphatase
Function / homology
Function and homology information


inositol-1,5-bisdiphosphate-2,3,4,6-tetrakisphosphate 5-diphosphatase activity / inositol-5-diphosphate-1,3,4,6-tetrakisphosphate diphosphatase activity / inositol diphosphate tetrakisphosphate diphosphatase activity / inositol-3,5-bisdiphosphate-2,3,4,6-tetrakisphosphate 5-diphosphatase activity / diphosphoinositol polyphosphate metabolic process / inositol-5-diphosphate-1,2,3,4,6-pentakisphosphate diphosphatase activity / diphosphoinositol-polyphosphate diphosphatase / phosphatase activity / actin filament organization / cytosol / cytoplasm
Similarity search - Function
Atypical dual-specificity phosphatase Siw14-like, plant and fungi / Atypical dual-specificity phosphatase Siw14-like / Tyrosine phosphatase family / Dual specificity protein phosphatase domain profile. / Dual specificity protein phosphatase domain / Protein tyrosine phosphatase superfamily / Protein-Tyrosine Phosphatase; Chain A / Tyrosine specific protein phosphatases active site. / Protein-tyrosine phosphatase, active site / Protein-tyrosine phosphatase-like ...Atypical dual-specificity phosphatase Siw14-like, plant and fungi / Atypical dual-specificity phosphatase Siw14-like / Tyrosine phosphatase family / Dual specificity protein phosphatase domain profile. / Dual specificity protein phosphatase domain / Protein tyrosine phosphatase superfamily / Protein-Tyrosine Phosphatase; Chain A / Tyrosine specific protein phosphatases active site. / Protein-tyrosine phosphatase, active site / Protein-tyrosine phosphatase-like / Alpha-Beta Complex / Alpha Beta
Similarity search - Domain/homology
Inositol diphosphatase SIW14
Similarity search - Component
Biological speciesSaccharomyces cerevisiae (brewer's yeast)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.5 Å
AuthorsFlorio, T. / Lokareddy, R. / Cingolani, G.
Funding support United States, 3items
OrganizationGrant numberCountry
National Institutes of Health/National Cancer Institute (NIH/NCI)P30CA56036 United States
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)R01GM122844 United States
National Institutes of Health/Office of the DirectorS10OD017987 United States
CitationJournal: Biochemistry / Year: 2019
Title: Molecular Architecture of the Inositol Phosphatase Siw14.
Authors: Florio, T.J. / Lokareddy, R.K. / Gillilan, R.E. / Cingolani, G.
History
DepositionJul 13, 2018Deposition site: RCSB / Processing site: RCSB
Revision 1.0Feb 27, 2019Provider: repository / Type: Initial release
Revision 1.1Dec 4, 2019Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.2Oct 11, 2023Group: Data collection / Database references / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_ncs_dom_lim
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_label_asym_id / _struct_ncs_dom_lim.beg_label_comp_id / _struct_ncs_dom_lim.beg_label_seq_id / _struct_ncs_dom_lim.end_auth_comp_id / _struct_ncs_dom_lim.end_label_asym_id / _struct_ncs_dom_lim.end_label_comp_id / _struct_ncs_dom_lim.end_label_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Tyrosine-protein phosphatase SIW14
B: Tyrosine-protein phosphatase SIW14
C: Tyrosine-protein phosphatase SIW14
D: Tyrosine-protein phosphatase SIW14
E: Tyrosine-protein phosphatase SIW14
F: Tyrosine-protein phosphatase SIW14
G: Tyrosine-protein phosphatase SIW14
H: Tyrosine-protein phosphatase SIW14
I: Tyrosine-protein phosphatase SIW14
J: Tyrosine-protein phosphatase SIW14
K: Tyrosine-protein phosphatase SIW14
L: Tyrosine-protein phosphatase SIW14
M: Tyrosine-protein phosphatase SIW14
N: Tyrosine-protein phosphatase SIW14
O: Tyrosine-protein phosphatase SIW14
P: Tyrosine-protein phosphatase SIW14
Q: Tyrosine-protein phosphatase SIW14
R: Tyrosine-protein phosphatase SIW14
S: Tyrosine-protein phosphatase SIW14
T: Tyrosine-protein phosphatase SIW14
V: Tyrosine-protein phosphatase SIW14
W: Tyrosine-protein phosphatase SIW14
X: Tyrosine-protein phosphatase SIW14
Y: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)479,01748
Polymers476,71224
Non-polymers2,30624
Water6,936385
1
A: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
B: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
C: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
4
D: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
5
E: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
6
F: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
7
G: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
8
H: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
9
I: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
10
J: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
11
K: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
12
L: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
13
M: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
14
N: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
15
O: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
16
P: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
17
Q: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
18
R: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
19
S: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
20
T: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
21
V: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
22
W: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
23
X: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
24
Y: Tyrosine-protein phosphatase SIW14
hetero molecules


Theoretical massNumber of molelcules
Total (without water)19,9592
Polymers19,8631
Non-polymers961
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)92.467, 160.487, 360.572
Angle α, β, γ (deg.)90.000, 90.320, 90.000
Int Tables number5
Space group name H-MC121
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
11(chain A and (resid 113 through 116 or (resid 117...
21(chain B and (resid 113 through 116 or (resid 117...
31(chain C and (resid 113 through 116 or (resid 117...
41(chain D and (resid 113 through 116 or (resid 117...
51(chain E and (resid 113 through 116 or (resid 117...
61(chain F and (resid 113 through 116 or (resid 117...
71(chain G and (resid 113 through 116 or (resid 117...
81(chain H and (resid 113 through 116 or (resid 117...
91(chain I and (resid 113 through 116 or (resid 117...
101(chain J and (resid 113 through 116 or (resid 117...
111(chain K and (resid 113 through 116 or (resid 117...
121(chain L and (resid 113 through 116 or (resid 117...
131(chain M and (resid 113 through 116 or (resid 117...
141(chain N and (resid 113 through 116 or (resid 117...
151(chain O and (resid 113 through 116 or (resid 117...
161(chain P and (resid 113 through 116 or (resid 117...
171(chain Q and (resid 113 through 116 or (resid 117...
181(chain R and (resid 113 through 116 or (resid 117...
191(chain S and (resid 113 through 154 or resid 156...
201(chain T and (resid 113 through 116 or (resid 117...
211(chain V and (resid 113 through 116 or (resid 117...
221(chain W and (resid 113 through 116 or (resid 117...
231(chain X and (resid 113 through 116 or (resid 117...
241(chain Y and (resid 113 through 116 or (resid 117...

NCS domain segments:

Ens-ID: 1

Dom-IDComponent-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
11ASNASNVALVAL(chain A and (resid 113 through 116 or (resid 117...AA113 - 1161 - 4
12ILEILEILEILE(chain A and (resid 113 through 116 or (resid 117...AA1175
13ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
14ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
15ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
16ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
17ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
18ASNASNTRPTRP(chain A and (resid 113 through 116 or (resid 117...AA113 - 2811 - 169
21ASNASNVALVAL(chain B and (resid 113 through 116 or (resid 117...BB113 - 1161 - 4
22ILEILEILEILE(chain B and (resid 113 through 116 or (resid 117...BB1175
23ASNASNTRPTRP(chain B and (resid 113 through 116 or (resid 117...BB113 - 2811 - 169
24ASNASNTRPTRP(chain B and (resid 113 through 116 or (resid 117...BB113 - 2811 - 169
25ASNASNTRPTRP(chain B and (resid 113 through 116 or (resid 117...BB113 - 2811 - 169
26ASNASNTRPTRP(chain B and (resid 113 through 116 or (resid 117...BB113 - 2811 - 169
27ASNASNTRPTRP(chain B and (resid 113 through 116 or (resid 117...BB113 - 2811 - 169
31ASNASNVALVAL(chain C and (resid 113 through 116 or (resid 117...CC113 - 1161 - 4
32ILEILEILEILE(chain C and (resid 113 through 116 or (resid 117...CC1175
33ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
34ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
35ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
36ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
37ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
38ASNASNTRPTRP(chain C and (resid 113 through 116 or (resid 117...CC113 - 2811 - 169
41ASNASNVALVAL(chain D and (resid 113 through 116 or (resid 117...DD113 - 1161 - 4
42ILEILEILEILE(chain D and (resid 113 through 116 or (resid 117...DD1175
43ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
44ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
45ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
46ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
47ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
48ASNASNTRPTRP(chain D and (resid 113 through 116 or (resid 117...DD113 - 2811 - 169
51ASNASNVALVAL(chain E and (resid 113 through 116 or (resid 117...EE113 - 1161 - 4
52ILEILEILEILE(chain E and (resid 113 through 116 or (resid 117...EE1175
53ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
54ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
55ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
56ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
57ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
58ASNASNTRPTRP(chain E and (resid 113 through 116 or (resid 117...EE113 - 2811 - 169
61ASNASNVALVAL(chain F and (resid 113 through 116 or (resid 117...FF113 - 1161 - 4
62ILEILEILEILE(chain F and (resid 113 through 116 or (resid 117...FF1175
63ASNASNTRPTRP(chain F and (resid 113 through 116 or (resid 117...FF113 - 2811 - 169
64ASNASNTRPTRP(chain F and (resid 113 through 116 or (resid 117...FF113 - 2811 - 169
65ASNASNTRPTRP(chain F and (resid 113 through 116 or (resid 117...FF113 - 2811 - 169
66ASNASNTRPTRP(chain F and (resid 113 through 116 or (resid 117...FF113 - 2811 - 169
67ASNASNTRPTRP(chain F and (resid 113 through 116 or (resid 117...FF113 - 2811 - 169
71ASNASNVALVAL(chain G and (resid 113 through 116 or (resid 117...GG113 - 1161 - 4
72ILEILEILEILE(chain G and (resid 113 through 116 or (resid 117...GG1175
73ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
74ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
75ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
76ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
77ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
78ASNASNTRPTRP(chain G and (resid 113 through 116 or (resid 117...GG113 - 2811 - 169
81ASNASNVALVAL(chain H and (resid 113 through 116 or (resid 117...HH113 - 1161 - 4
82ILEILEILEILE(chain H and (resid 113 through 116 or (resid 117...HH1175
83ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
84ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
85ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
86ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
87ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
88ASNASNTRPTRP(chain H and (resid 113 through 116 or (resid 117...HH113 - 2811 - 169
91ASNASNVALVAL(chain I and (resid 113 through 116 or (resid 117...II113 - 1161 - 4
92ILEILEILEILE(chain I and (resid 113 through 116 or (resid 117...II1175
93ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
94ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
95ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
96ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
97ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
98ASNASNTRPTRP(chain I and (resid 113 through 116 or (resid 117...II113 - 2811 - 169
101ASNASNVALVAL(chain J and (resid 113 through 116 or (resid 117...JJ113 - 1161 - 4
102ILEILEILEILE(chain J and (resid 113 through 116 or (resid 117...JJ1175
103ASNASNTRPTRP(chain J and (resid 113 through 116 or (resid 117...JJ113 - 2811 - 169
104ASNASNTRPTRP(chain J and (resid 113 through 116 or (resid 117...JJ113 - 2811 - 169
105ASNASNTRPTRP(chain J and (resid 113 through 116 or (resid 117...JJ113 - 2811 - 169
106ASNASNTRPTRP(chain J and (resid 113 through 116 or (resid 117...JJ113 - 2811 - 169
107ASNASNTRPTRP(chain J and (resid 113 through 116 or (resid 117...JJ113 - 2811 - 169
111ASNASNVALVAL(chain K and (resid 113 through 116 or (resid 117...KK113 - 1161 - 4
112ILEILEILEILE(chain K and (resid 113 through 116 or (resid 117...KK1175
113ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
114ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
115ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
116ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
117ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
118ASNASNTRPTRP(chain K and (resid 113 through 116 or (resid 117...KK113 - 2811 - 169
121ASNASNVALVAL(chain L and (resid 113 through 116 or (resid 117...LL113 - 1161 - 4
122ILEILEILEILE(chain L and (resid 113 through 116 or (resid 117...LL1175
123ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
124ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
125ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
126ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
127ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
128ASNASNTRPTRP(chain L and (resid 113 through 116 or (resid 117...LL113 - 2811 - 169
131ASNASNVALVAL(chain M and (resid 113 through 116 or (resid 117...MM113 - 1161 - 4
132ILEILEILEILE(chain M and (resid 113 through 116 or (resid 117...MM1175
133ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
134ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
135ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
136ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
137ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
138ASNASNTRPTRP(chain M and (resid 113 through 116 or (resid 117...MM113 - 2811 - 169
141ASNASNVALVAL(chain N and (resid 113 through 116 or (resid 117...NN113 - 1161 - 4
142ILEILEILEILE(chain N and (resid 113 through 116 or (resid 117...NN1175
143ASNASNTRPTRP(chain N and (resid 113 through 116 or (resid 117...NN113 - 2811 - 169
144ASNASNTRPTRP(chain N and (resid 113 through 116 or (resid 117...NN113 - 2811 - 169
145ASNASNTRPTRP(chain N and (resid 113 through 116 or (resid 117...NN113 - 2811 - 169
146ASNASNTRPTRP(chain N and (resid 113 through 116 or (resid 117...NN113 - 2811 - 169
147ASNASNTRPTRP(chain N and (resid 113 through 116 or (resid 117...NN113 - 2811 - 169
151ASNASNVALVAL(chain O and (resid 113 through 116 or (resid 117...OO113 - 1161 - 4
152ILEILEILEILE(chain O and (resid 113 through 116 or (resid 117...OO1175
153ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
154ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
155ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
156ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
157ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
158ASNASNTRPTRP(chain O and (resid 113 through 116 or (resid 117...OO113 - 2811 - 169
161ASNASNVALVAL(chain P and (resid 113 through 116 or (resid 117...PP113 - 1161 - 4
162ILEILEILEILE(chain P and (resid 113 through 116 or (resid 117...PP1175
163ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
164ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
165ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
166ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
167ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
168ASNASNTRPTRP(chain P and (resid 113 through 116 or (resid 117...PP113 - 2811 - 169
171ASNASNVALVAL(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 1161 - 4
172ILEILEILEILE(chain Q and (resid 113 through 116 or (resid 117...QQ1175
173ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
174ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
175ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
176ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
177ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
178ASNASNTRPTRP(chain Q and (resid 113 through 116 or (resid 117...QQ113 - 2811 - 169
181ASNASNVALVAL(chain R and (resid 113 through 116 or (resid 117...RR113 - 1161 - 4
182ILEILEILEILE(chain R and (resid 113 through 116 or (resid 117...RR1175
183ASNASNTRPTRP(chain R and (resid 113 through 116 or (resid 117...RR113 - 2811 - 169
184ASNASNTRPTRP(chain R and (resid 113 through 116 or (resid 117...RR113 - 2811 - 169
185ASNASNTRPTRP(chain R and (resid 113 through 116 or (resid 117...RR113 - 2811 - 169
186ASNASNTRPTRP(chain R and (resid 113 through 116 or (resid 117...RR113 - 2811 - 169
187ASNASNTRPTRP(chain R and (resid 113 through 116 or (resid 117...RR113 - 2811 - 169
191ASNASNVALVAL(chain S and (resid 113 through 154 or resid 156...SS113 - 1541 - 42
192ILEILEASNASN(chain S and (resid 113 through 154 or resid 156...SS156 - 18344 - 71
193PROPROASNASN(chain S and (resid 113 through 154 or resid 156...SS186 - 21574 - 103
194GLYGLYTRPTRP(chain S and (resid 113 through 154 or resid 156...SS217 - 281105 - 169
201ASNASNVALVAL(chain T and (resid 113 through 116 or (resid 117...TT113 - 1161 - 4
202ILEILEILEILE(chain T and (resid 113 through 116 or (resid 117...TT1175
203ASNASNTRPTRP(chain T and (resid 113 through 116 or (resid 117...TT113 - 2811 - 169
204ASNASNTRPTRP(chain T and (resid 113 through 116 or (resid 117...TT113 - 2811 - 169
205ASNASNTRPTRP(chain T and (resid 113 through 116 or (resid 117...TT113 - 2811 - 169
206ASNASNTRPTRP(chain T and (resid 113 through 116 or (resid 117...TT113 - 2811 - 169
207ASNASNTRPTRP(chain T and (resid 113 through 116 or (resid 117...TT113 - 2811 - 169
211ASNASNVALVAL(chain V and (resid 113 through 116 or (resid 117...VU113 - 1161 - 4
212ILEILEILEILE(chain V and (resid 113 through 116 or (resid 117...VU1175
213ASNASNTRPTRP(chain V and (resid 113 through 116 or (resid 117...VU113 - 2811 - 169
214ASNASNTRPTRP(chain V and (resid 113 through 116 or (resid 117...VU113 - 2811 - 169
215ASNASNTRPTRP(chain V and (resid 113 through 116 or (resid 117...VU113 - 2811 - 169
216ASNASNTRPTRP(chain V and (resid 113 through 116 or (resid 117...VU113 - 2811 - 169
217ASNASNTRPTRP(chain V and (resid 113 through 116 or (resid 117...VU113 - 2811 - 169
221ASNASNVALVAL(chain W and (resid 113 through 116 or (resid 117...WV113 - 1161 - 4
222ILEILEILEILE(chain W and (resid 113 through 116 or (resid 117...WV1175
223ASNASNTRPTRP(chain W and (resid 113 through 116 or (resid 117...WV113 - 2811 - 169
224ASNASNTRPTRP(chain W and (resid 113 through 116 or (resid 117...WV113 - 2811 - 169
225ASNASNTRPTRP(chain W and (resid 113 through 116 or (resid 117...WV113 - 2811 - 169
226ASNASNTRPTRP(chain W and (resid 113 through 116 or (resid 117...WV113 - 2811 - 169
227ASNASNTRPTRP(chain W and (resid 113 through 116 or (resid 117...WV113 - 2811 - 169
231ASNASNVALVAL(chain X and (resid 113 through 116 or (resid 117...XW113 - 1161 - 4
232ILEILEILEILE(chain X and (resid 113 through 116 or (resid 117...XW1175
233ASNASNTRPTRP(chain X and (resid 113 through 116 or (resid 117...XW113 - 2811 - 169
234ASNASNTRPTRP(chain X and (resid 113 through 116 or (resid 117...XW113 - 2811 - 169
235ASNASNTRPTRP(chain X and (resid 113 through 116 or (resid 117...XW113 - 2811 - 169
236ASNASNTRPTRP(chain X and (resid 113 through 116 or (resid 117...XW113 - 2811 - 169
237ASNASNTRPTRP(chain X and (resid 113 through 116 or (resid 117...XW113 - 2811 - 169
241ASNASNVALVAL(chain Y and (resid 113 through 116 or (resid 117...YX113 - 1161 - 4
242ILEILEILEILE(chain Y and (resid 113 through 116 or (resid 117...YX1175
243ASNASNTRPTRP(chain Y and (resid 113 through 116 or (resid 117...YX113 - 2811 - 169
244ASNASNTRPTRP(chain Y and (resid 113 through 116 or (resid 117...YX113 - 2811 - 169
245ASNASNTRPTRP(chain Y and (resid 113 through 116 or (resid 117...YX113 - 2811 - 169
246ASNASNTRPTRP(chain Y and (resid 113 through 116 or (resid 117...YX113 - 2811 - 169

-
Components

#1: Protein ...
Tyrosine-protein phosphatase SIW14


Mass: 19862.980 Da / Num. of mol.: 24 / Fragment: catalytic core
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Saccharomyces cerevisiae (brewer's yeast)
Gene: SIW14 / Production host: Escherichia coli (E. coli) / References: UniProt: P53965, protein-tyrosine-phosphatase
#2: Chemical...
ChemComp-SO4 / SULFATE ION


Mass: 96.063 Da / Num. of mol.: 24 / Source method: obtained synthetically / Formula: SO4
#3: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 385 / Source method: isolated from a natural source / Formula: H2O

-
Experimental details

-
Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

-
Sample preparation

CrystalDensity Matthews: 2.81 Å3/Da / Density % sol: 56.17 %
Crystal growTemperature: 295 K / Method: vapor diffusion, hanging drop / pH: 7.5
Details: 0.2 M magnesium chloride, 0.1 M HEPES pH 7.5, 17-25% (w/v) PEG3350

-
Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: SSRL / Beamline: BL9-2 / Wavelength: 0.97 Å
DetectorType: DECTRIS PILATUS 6M / Detector: PIXEL / Date: Feb 17, 2017
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97 Å / Relative weight: 1
Reflection twinOperator: h,-k,-l / Fraction: 0.45
ReflectionResolution: 2.5→50 Å / Num. obs: 166746 / % possible obs: 91.3 % / Redundancy: 2.3 % / Biso Wilson estimate: 37.4 Å2 / Rpim(I) all: 0.0105 / Rsym value: 0.0135 / Net I/σ(I): 11.5
Reflection shellResolution: 2.5→2.59 Å / Redundancy: 2 % / Mean I/σ(I) obs: 1.9 / Rpim(I) all: 0.0609 / Rsym value: 0.0788

-
Processing

Software
NameVersionClassification
PHENIX1.14_3260refinement
PDB_EXTRACT3.24data extraction
HKL-2000data reduction
HKL-2000data scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 2q47
Resolution: 2.5→14.995 Å / Cross valid method: THROUGHOUT / σ(F): 232.13 / Phase error: 26.91 / Stereochemistry target values: TWIN_LSQ_F
RfactorNum. reflection% reflection
Rfree0.2463 2202 1.35 %
Rwork0.2298 157333 -
obs0.2429 163094 90.4 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso max: 164.16 Å2 / Biso mean: 55.5306 Å2 / Biso min: 2 Å2
Refinement stepCycle: final / Resolution: 2.5→14.995 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms33542 0 120 385 34047
Biso mean--47.74 34.38 -
Num. residues----4055
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDRmsType
11A11808X-RAY DIFFRACTION2.954TORSIONAL
12B11808X-RAY DIFFRACTION2.954TORSIONAL
13C11808X-RAY DIFFRACTION2.954TORSIONAL
14D11808X-RAY DIFFRACTION2.954TORSIONAL
15E11808X-RAY DIFFRACTION2.954TORSIONAL
16F11808X-RAY DIFFRACTION2.954TORSIONAL
17G11808X-RAY DIFFRACTION2.954TORSIONAL
18H11808X-RAY DIFFRACTION2.954TORSIONAL
19I11808X-RAY DIFFRACTION2.954TORSIONAL
110J11808X-RAY DIFFRACTION2.954TORSIONAL
111K11808X-RAY DIFFRACTION2.954TORSIONAL
112L11808X-RAY DIFFRACTION2.954TORSIONAL
113M11808X-RAY DIFFRACTION2.954TORSIONAL
114N11808X-RAY DIFFRACTION2.954TORSIONAL
115O11808X-RAY DIFFRACTION2.954TORSIONAL
116P11808X-RAY DIFFRACTION2.954TORSIONAL
117Q11808X-RAY DIFFRACTION2.954TORSIONAL
118R11808X-RAY DIFFRACTION2.954TORSIONAL
119S11808X-RAY DIFFRACTION2.954TORSIONAL
120T11808X-RAY DIFFRACTION2.954TORSIONAL
121V11808X-RAY DIFFRACTION2.954TORSIONAL
122W11808X-RAY DIFFRACTION2.954TORSIONAL
123X11808X-RAY DIFFRACTION2.954TORSIONAL
124Y11808X-RAY DIFFRACTION2.954TORSIONAL
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 14

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.5073-2.56860.38021880.343898601004879
2.5686-2.63650.37671060.338110561116288
2.6365-2.71210.36161020.3446113221142490
2.7121-2.79730.31412020.3267113971159991
2.7973-2.89430.36071030.3158115931169692
2.8943-3.00620.3281020.3042115621166493
3.0062-3.13790.34312100.2933112011141189
3.1379-3.2960.29961140.2706117381185293
3.296-3.49180.27311180.2547115041162292
3.4918-3.74440.2661980.2339113671156590
3.7444-4.09080.23531050.2188111471125288
4.0908-4.61590.2011980.1908112291142789
4.6159-5.58890.2376850.1912110001108588
5.5889-9.18980.18411640.2166113571152189
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
10.67610.19130.26450.09920.24230.8248-0.04610.10960.94440.1206-0.30110.3598-0.46680.0586-0.00750.3245-0.0348-0.00480.5418-0.07340.732611.066520.4489127.9856
20.0421-0.0783-0.03780.12670.090.1199-0.0873-0.32230.90330.3414-0.29040.38950.27840.1841-0.00040.45370.02030.02270.4620.0670.715621.54210.6319131.0088
30.704-0.4765-1.51840.75372.2096.45420.31510.07540.9665-0.68030.0957-0.377-1.09970.45920.47640.30640.1113-0.03550.38450.13680.939214.039119.347121.3478
40.3932-0.1920.13430.4961-0.47260.4294-0.05880.06910.6155-0.66890.0428-0.5629-0.0025-0.12030.00180.51480.01210.1510.38770.13650.843520.145411.7794117.9846
50.3471-0.3553-0.00320.3642-0.0540.1103-0.13250.68860.3361-0.3114-0.1775-0.28090.36970.27590.00320.5118-0.0790.17140.54310.21570.838921.643816.4106113.0597
60.28560.0551-0.66431.6792-0.47881.5873-0.0428-0.0829-0.6031-0.0945-0.303-0.1190.9515-0.5083-1.40261.22960.06880.12890.40460.26210.414213.9508-6.8968116.9062
70.1455-0.0988-0.1290.3036-0.05230.21610.2870.68450.19070.9648-0.1649-0.43040.22040.3935-0.00430.46410.04420.02120.36860.01830.768727.8469-0.6491121.7317
80.1758-0.2571-0.09730.47570.01960.73820.0836-0.31411.0056-0.2405-0.2053-0.2133-0.09570.4377-0.00060.35770.01250.01490.54590.15930.713320.63068.1227123.6709
90.1209-0.1045-0.10810.0820.09180.1596-0.75140.567-0.3192-0.73640.26-0.460.53660.4577-0.01130.5654-0.13680.06830.42950.05140.636521.449-0.4436129.2845
103.6218-3.1185-0.98533.25310.67350.40020.6786-0.52451.0153-0.08810.0206-0.8885-0.43460.23420.21641.0417-0.04960.07910.352-0.00190.327816.6018-1.3567136.6987
110.6842-0.25140.44310.1309-0.1870.5440.31260.35910.1797-0.53040.12740.5212-0.01930.3935-0.00080.4984-0.05070.04550.42610.00620.582712.6828-6.9978128.621
120.02790.0147-0.19980.008-0.10941.54950.2137-0.051-0.6385-0.1421-0.3787-0.36720.23060.4817-0.00930.67080.14140.17810.40720.09750.890334.4519-5.3324128.0523
130.4655-0.57030.60510.7133-0.75260.7946-0.0335-0.0058-0.2310.39140.6009-0.0151-0.3073-0.22870.04810.6004-0.1014-0.17510.5099-0.06831.041734.16615.684133.4649
140.3912-0.11130.09650.6790.06710.52850.26450.14220.0123-0.4483-0.29090.55230.6756-0.1329-0.00460.61590.08790.02040.49130.00960.5379-24.0204-0.7462126.9765
150.1890.34580.1720.80710.77281.4044-0.1125-0.28020.0020.13180.010.0970.5345-0.50220.12470.6606-0.1153-0.06490.5627-0.17730.1376-20.990913.3932127.0491
160.198-0.1907-0.43960.20680.36191.3011-0.2390.4408-0.9148-0.0145-0.0757-0.07240.1909-0.9258-0.00380.5075-0.07590.08520.4052-0.06780.423-24.2260.911119.6016
170.6509-0.10780.38740.1855-0.10260.2386-0.15850.6632-0.14890.1234-0.22880.19990.39560.0971-0.01210.57490.0502-0.05540.4911-0.07590.361-20.61788.9206115.1425
181.2511-1.08911.61930.9431-1.40872.12740.08960.6679-0.1444-0.9111-0.46260.06810.26040.4691-0.42010.4442-0.0371-0.00650.456-0.20020.7535-24.78576.7119110.086
191.18080.23050.25841.71560.60190.70890.1127-0.1225-0.43630.8722-0.2873-0.85910.17520.86050.03140.917-0.1641-0.07470.83730.25040.5794-1.369912.6522113.4871
200.10710.01910.10860.0761-0.04220.1381-0.49780.49880.0719-0.7581-0.0628-0.359-0.52730.243-0.00020.77320.04480.00960.35430.09360.5307-13.169122.3297115.5636
210.40150.54270.15790.72790.35710.42790.2374-0.01680.2997-0.6527-0.1920.1879-0.21680.17250.00070.7928-0.05990.03040.3976-0.04980.3332-17.989412.9622120.1697
220.1563-0.2029-0.01050.25750.02320.04060.33790.59420.7138-0.2193-0.5553-0.5941-0.0932-0.2634-0.00580.46850.088-0.0150.404-0.07610.4145-11.297518.2399124.8114
230.31490.1623-0.00530.22360.07540.1835-0.3407-0.46550.22050.16050.61580.3050.6980.09480.00440.655-0.03310.00120.3291-0.02550.4573-8.491916.1819132.9677
240.5411-0.02580.00570.3118-0.12250.15410.45360.2478-0.46010.5569-0.5234-0.5303-0.48240.33420.00140.5107-0.1039-0.01360.60640.08410.7404-2.275216.8066124.9869
250.2261-0.0518-0.28070.0823-0.1431.0271-0.11910.06840.8113-0.1499-0.58190.0582-0.1880.3816-0.00490.9677-0.0652-0.21270.41340.1590.9555-15.345732.6584120.6836
262.5592-0.23431.29070.0205-0.12330.64090.2643-0.6383-0.011-0.28880.18830.1373-0.7561-0.30660.13271.0223-0.11180.110.4272-0.15070.634-23.017627.0207127.3544
270.727-0.17170.01140.55140.65590.8634-0.109-0.5789-1.01940.3580.05860.0308-0.0240.0582-0.00180.38940.00040.0940.36870.02390.51877.3524-23.0328128.9447
280.5431-0.3344-0.30180.41080.14360.13810.1198-0.0749-0.4185-0.6287-0.1356-0.07670.1084-0.1261-0.00020.5487-0.0461-0.00070.3147-0.00690.66514.277-27.0808118.0783
290.1565-0.2571-0.54350.41321.06433.0385-0.03090.1392-0.0217-0.28660.40120.1393-1.7380.25790.1770.7967-0.0487-0.07270.5685-0.17910.7915-11.6126-17.3328116.8611
301.1509-0.5042-0.8111.07490.43511.2684-0.10960.1961-0.11420.13020.12790.53060.1199-0.1098-0.0010.3906-0.04110.01190.39940.01860.6221-11.4014-18.603128.2622
310.30850.2358-0.57770.7478-1.02372.5445-0.1860.2759-0.5337-0.04010.75640.50690.6438-0.3690.21090.76390.11760.21720.4940.12910.7619-12.9858-33.3894133.1986
320.07060.12430.12060.7079-0.45940.6041-0.20760.08730.1106-0.69430.08360.725-0.0681-0.3033-0.00630.4686-0.01730.04830.33930.04110.6027-69.2992-31.974498.4835
330.4410.1231-0.40480.55650.07520.4079-0.2708-0.18450.2172-0.326-0.0028-0.2281-0.0585-0.01090.00030.60280.00640.11870.267-0.02090.655-67.3601-38.7431106.192
342.8328-0.57170.02320.72330.57850.785-0.36040.18310.9740.17310.0007-0.14020.4770.7857-0.12410.94750.03970.29340.66720.0720.5417-61.4943-39.9619109.8398
350.9479-0.53450.26990.49850.33540.8180.00130.0154-0.26280.2347-0.2110.04740.37760.106900.567-0.02540.11940.3358-0.05690.5195-58.5445-44.448496.2144
360.7879-0.3397-0.70070.5267-0.03010.7036-0.22080.1922-0.3934-0.48260.2935-0.11270.132-0.0468-0.00330.7052-0.12540.01240.36180.03130.6831-56.5901-50.872795.0281
371.041-0.59620.2371.12280.68920.8222-0.1197-0.01920.16550.12840.0641-0.21720.07550.01450.00010.469-0.01410.07750.4535-0.04480.3726-40.4239-5.0417104.3584
381.2919-0.6140.30050.6885-0.13770.8759-0.313-0.2681-0.8630.8790.2231-0.04370.0615-0.4587-0.00580.9111-0.19660.14320.7073-0.08970.5688-47.7048-10.0384113.6513
390.88580.41390.26320.81220.41871.18350.1152-0.1559-0.0151-0.047-0.10710.3146-0.0551-0.29580.00050.490.0247-0.00560.3996-0.03850.5092-57.5215-7.2032100.6359
400.3711-0.28560.46450.4784-0.4260.602-0.0166-0.2042-0.42670.0617-0.2619-0.45050.33530.0792-0.00070.64330.0097-0.00160.40170.03810.4522-30.313-45.09396.4183
411.1960.8742-0.12691.2068-0.87691.7455-0.203-0.2040.01060.2963-0.47060.1673-0.5922-0.0606-0.01270.6524-0.0353-0.11320.55380.0540.4218-27.4426-38.6706108.2137
420.48150.0595-0.08851.8191-0.5531.6001-0.0428-0.01120.1030.0472-0.0637-0.44660.00930.2084-0.00020.4494-0.08830.08480.505-0.02830.6067-22.5919-27.364497.8558
430.2057-0.48870.16941.2737-0.31470.2201-0.06780.23980.2330.202-0.1084-0.71160.31950.0387-0.04110.6994-0.08530.14190.5984-0.07330.509-34.8037-6.19237.8623
446.7618-0.8415.37652.1251-0.47434.7173-0.39330.56310.8061-0.2348-0.8739-0.08860.04650.3773-1.4970.0964-0.06260.20980.7554-0.36260.8858-48.5344-1.91435.0379
451.3199-1.41160.93532.6104-1.8321.3084-0.2731-0.04570.88421.0825-0.0274-1.1171-0.38010.6397-0.1280.5932-0.04910.0390.6143-0.07790.513-37.3978-4.24514.7941
460.6432-0.45040.42341.42690.00860.6285-0.28460.00380.09530.6301-0.0487-0.3006-0.9046-0.4878-0.07850.73820.12670.10190.6174-0.03640.3659-45.3648-1.054120.2435
470.73170.06970.80020.7185-0.15181.0846-0.3402-0.6124-0.8371-0.2353-0.19430.02480.8305-0.10180.01920.65110.00280.2311.1518-0.24280.7895-59.7939-17.768518.6527
481.0871-0.1342-0.3670.106-0.04780.21350.08610.20360.959-0.21170.0092-0.25850.2163-0.4215-0.02420.4661-0.18640.10170.5027-0.10810.5361-61.7746-2.906814.7554
490.4603-0.03820.28620.0639-0.00470.39020.02520.02620.32160.36040.0640.492-0.13770.33010.00070.4973-0.00010.1440.528-0.05050.7399-50.9375-3.709512.0454
500.0754-0.10030.00230.1365-0.05350.09970.04540.23670.0597-0.1854-0.294-0.1362-0.2168-0.2045-0.00150.75280.16770.0080.629-0.16150.4891-58.128-7.56266.5246
510.19730.37480.02540.58160.0990.3358-0.01520.1849-0.09320.02790.06780.0747-0.1944-0.3479-0.00140.3804-0.00290.06540.4432-0.05190.6782-57.8293-14.98612.5334
520.1145-0.10980.24180.3277-0.01540.7347-0.69020.1042-0.40530.33270.00190.2433-0.2781-0.5588-0.01880.5109-0.01490.09930.62390.14031.3807-68.77681.30647.7431
530.00020.00240.00380.00120.04130.09120.28450.16310.3354-0.3351-0.00130.35060.0786-0.2436-0.00310.62350.1573-0.22860.6145-0.22030.9957-58.96256.84582.2746
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1421.23831.2360.6343.10071.02411.224-0.0327-0.541-0.96270.78040.5816-0.5414-0.22450.31930.21110.39520.08610.15940.77370.2490.6752-4.7311-22.1157154.7336
1430.569-0.15240.29050.4145-0.25480.4143-0.3236-0.0705-0.01670.04010.1326-0.1641-0.147-0.1104-0.36850.87070.92850.40971.2380.6590.9982-8.8398-24.4173159.5553
1440.2208-0.2108-0.04030.6754-0.3460.31-0.0681-0.22570.7227-0.2268-0.29260.7274-0.82070.1558-0.01291.07220.06230.03360.98210.13680.98.4496-6.9299157.3198
1450.497-0.4694-0.34580.45450.32630.24960.1218-0.37130.2527-0.33570.0986-0.86170.05990.66610.02080.85240.2522-0.00290.72180.06660.459310.7899-21.8767155.1324
1460.58020.29910.0920.84840.08680.6783-0.3736-0.4356-0.09840.57340.6095-0.10460.1595-0.37840.0110.53870.25230.17560.69030.22430.53430.6233-21.4053150.0235
1470.00720.0203-0.03570.0934-0.33111.1807-0.24250.07840.99280.2621-0.3407-0.0004-0.12640.3003-0.20210.71250.19430.08920.3398-0.07870.59558.9121-18.038145.8669
1480.65570.8129-0.27210.9118-0.29130.4566-0.2265-0.36680.26530.76790.07530.3843-0.35960.2515-0.00230.63420.04420.07890.4641-0.03830.41459.6311-11.0849141.3333
1490.2171-0.17270.04410.1823-0.10420.1214-0.1619-0.4017-0.37620.049-0.3354-0.31031.08120.48590.00840.69040.1650.03880.70360.10330.844318.7428-26.2749150.2914
1500.55880.6581.47230.77561.72153.8296-0.1588-0.1696-0.6705-0.08210.9865-0.35970.84860.6420.22530.5932-0.02650.16030.9774-0.0460.594710.4635-32.8201143.3495
1510.8604-0.0591-0.2520.38850.43970.8339-0.58060.05250.15450.28110.1886-0.33110.0112-0.2675-0.02430.63570.11490.1190.5155-0.05960.5293-18.100416.4778138.6251
1520.0947-0.0257-0.10480.10430.06590.1170.0921-0.85520.8660.14830.17210.083-0.46960.00490.01660.6350.0674-0.11890.5488-0.10280.5446-16.391421.5068146.0212
1530.2975-0.4666-0.28311.8390.4410.2609-0.6031-1.0076-0.18941.10710.3097-0.06810.0865-0.0945-1.26310.30210.3969-0.2670.80010.06760.4805-22.451514.6726150.285
1540.5849-0.3320.23530.193-0.04290.6888-0.288-0.78330.20440.08010.2127-0.0568-0.4875-0.09990.00220.7610.3188-0.10150.8224-0.02380.4255-23.77920.226154.3679
1550.011-0.0787-0.04020.50750.27190.17920.1748-1.1591-0.60730.09-0.1772-0.20590.57210.87040.01420.87950.05530.26681.28620.3810.9733-22.4287-1.2024152.6175
1560.08210.09320.0250.29690.32110.32210.1882-0.4411-0.21640.2983-0.1410.29220.7533-0.2286-0.00290.51970.05160.04260.5635-0.01210.5448-23.57066.1883143.7538
1570.8648-0.0107-0.01980.37420.05440.11390.39660.4769-0.68690.3903-0.2069-0.1243-0.3487-0.37650.02360.51830.03010.18260.54150.08160.689-18.7882-1.3703134.3112
1580.4656-0.2770.45270.71690.31280.98760.433-0.40870.13430.53220.44860.18960.6704-0.31650.04410.87630.09040.18320.58450.17330.7494-17.8596-5.9765143.2599
1590.1569-0.1226-0.3283.66381.14220.8330.2919-1.1416-0.7936-0.6757-0.28650.52080.1254-0.5630.02910.38610.0582-0.02081.02010.06720.7708-37.46331.6662139.0262
1600.35660.05990.09240.84440.11640.3274-0.26460.0412-0.1760.5378-0.130.1996-0.3433-0.0659-0.05321.285-0.0399-0.12270.4309-0.16911.8109-60.994-5.281173.2831
1610.118-0.10850.09650.109-0.09070.0661-0.6331-0.4284-0.34560.8444-0.1124-0.1109-0.42930.4435-0.00180.7918-0.07-0.1170.5560.09070.931-46.692-1.5023172.6245
1620.70990.3310.26180.2324-0.05010.7854-0.29230.51560.08480.22860.4006-0.6628-0.8782-0.65080.00380.6470.13380.09830.74250.13190.6853-59.8566-4.0583166.1081
1630.39830.0662-0.14050.33270.11650.43880.35110.30860.3089-0.06010.3223-0.7050.05030.35560.00960.8730.0020.06840.7753-0.14040.4581-51.5376-3.2483160.8609
1640.0392-0.09210.04910.21310.0250.26790.23561.30070.7319-0.4465-0.1791-0.04920.70210.12780.00160.91360.0680.03030.7385-0.05440.7604-55.8359-0.0131156.1542
1650.1293-0.04050.1490.3421-0.19090.2644-0.48960.3417-0.38370.0081-0.31480.12081.2701-0.2202-0.00311.31930.37230.27841.65090.2731.1399-38.3962-17.7502157.7896
1660.36360.12550.13540.1398-0.11680.30440.26690.5242-0.0751-0.0250.32210.0144-0.3160.0498-0.00090.99130.1258-0.01290.93080.07140.6642-36.5109-2.08160.798
1670.0423-0.1104-0.00170.4218-0.05410.9288-0.0553-0.7456-0.299-0.17820.4246-1.33020.44031.24180.07070.6738-0.0627-0.09990.669-0.20941.2028-46.8278-4.2919165.5179
1681.0940.38240.53390.18670.16430.3643-0.8340.5643-1.22980.55341.05830.17730.27930.12160.0170.98290.05610.12750.59810.0570.8176-37.6193-9.7657174.5235
1690.26690.0039-0.12820.10910.28960.74990.2058-0.85580.0529-0.13180.6935-0.5487-0.6468-0.42460.04230.68550.0916-0.03280.55770.08321.1587-36.3961-17.9491169.7172
1700.43690.1751-0.22290.1603-0.25620.42310.10430.42440.4651.2010.114-0.0376-0.22540.2723-0.02141.2076-0.2330.18270.7985-0.14580.8501-30.9883.5943167.8287
1711.0769-0.0393-0.04030.05670.15670.3989-0.09590.2118-0.9439-0.2885-0.3289-0.3504-0.1730.50610.01170.69130.1429-0.01410.63970.01540.5414-59.5013-46.6378175.0886
1720.9938-0.3869-0.10610.80790.09860.11920.72730.4133-1.16170.4513-0.237-0.57450.28550.13470.11640.52580.1833-0.13640.5481-0.26280.7495-65.6705-42.2221172.1311
1730.7189-0.29421.12041.1397-0.6712.8088-0.10440.8354-0.1548-0.614-0.487-0.1007-0.26610.0448-3.05670.84530.4251-0.04830.9604-0.2940.1386-68.8326-39.2777165.0359
1740.298-0.0050.41410.45230.20850.68570.1690.29120.1765-0.0369-0.59510.22550.3772-0.1144-0.8380.57180.18680.10031.3185-0.39070.4803-70.5136-44.2315160.5329
1752.0435-0.5721-0.78522.15730.90880.53960.0178-0.12020.5716-0.0298-0.1394-0.3983-0.77490.050.52581.70560.4141-0.36181.43740.28070.7267-63.4092-20.666161.4076
1761.67220.36360.38870.5806-0.09970.4773-0.52670.52681.10640.08250.27120.30250.21910.1322-0.03120.49540.18250.04030.6708-0.04680.7015-73.0231-31.3626168.8727
1771.05210.42510.0380.224-0.02830.36370.54770.13281.5713-0.1183-0.4823-0.3159-0.1411-0.157-0.00920.59340.04850.15380.44370.02150.7214-66.8443-24.8296179.2074
1780.07920.14380.16640.20340.2680.23040.5569-0.23380.39060.20020.00230.0386-0.2238-0.1490.0021.00070.07710.21360.55840.11411.2368-71.7323-20.2439172.8822
1790.01170.0672-0.01150.31920.03360.52691.11090.29740.47870.1242-0.12450.4637-0.76340.09520.19720.61050.092-0.02390.62430.26770.6115-82.5243-31.6361180.2459
1800.8935-0.3158-0.55681.8789-0.46341.0734-0.03850.35260.57960.55660.0092-0.2391-0.20040.4451-0.21940.70530.27840.14610.8537-0.0757-0.0885-25.9594-32.3421171.5825
1810.09640.0960.0870.13190.12820.1549-0.17060.15780.018-0.1734-0.0141-0.0243-0.5844-0.1844-0.21310.79590.44150.08881.28030.550.1524-24.4037-28.0861163.8647
1820.1886-0.06130.14670.3523-0.14440.12080.44890.82990.332-0.3399-0.3486-0.1044-0.5705-0.5155-0.00050.6240.11470.05041.0759-0.00110.4778-26.2869-36.1446157.525
1830.940.0845-0.20250.3341-0.04880.2127-0.07310.6071-0.04170.00660.2298-0.070.15630.28070.26731.36940.5902-0.2771.3176-0.18440.2475-47.6921-40.9939160.272
1841.8014-0.25590.2490.4735-0.41790.4930.3161.3162-0.93020.29830.02610.35360.5904-0.36630.35290.48920.1832-0.01390.7745-0.31010.6308-33.9183-43.9799166.7352
1850.4035-0.2583-0.46610.79050.19131.14240.3616-0.1006-0.091-0.98730.1858-0.1842-0.7235-0.43320.07180.45110.1008-0.01060.52480.05090.5825-43.2133-41.0695175.9281
1860.09660.08420.01660.0863-0.05910.25680.2676-0.1483-0.8641-0.0939-0.3038-0.32610.4199-0.3585-0.02280.81920.10040.08280.6192-0.29120.8816-31.0933-56.1882171.4188
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 113 through 122 )A113 - 122
2X-RAY DIFFRACTION2chain 'A' and (resid 123 through 132 )A123 - 132
3X-RAY DIFFRACTION3chain 'A' and (resid 133 through 145 )A133 - 145
4X-RAY DIFFRACTION4chain 'A' and (resid 146 through 161 )A146 - 161
5X-RAY DIFFRACTION5chain 'A' and (resid 162 through 177 )A162 - 177
6X-RAY DIFFRACTION6chain 'A' and (resid 178 through 191 )A178 - 191
7X-RAY DIFFRACTION7chain 'A' and (resid 192 through 203 )A192 - 203
8X-RAY DIFFRACTION8chain 'A' and (resid 204 through 219 )A204 - 219
9X-RAY DIFFRACTION9chain 'A' and (resid 220 through 231 )A220 - 231
10X-RAY DIFFRACTION10chain 'A' and (resid 232 through 247 )A232 - 247
11X-RAY DIFFRACTION11chain 'A' and (resid 248 through 261 )A248 - 261
12X-RAY DIFFRACTION12chain 'A' and (resid 262 through 273 )A262 - 273
13X-RAY DIFFRACTION13chain 'A' and (resid 274 through 281 )A274 - 281
14X-RAY DIFFRACTION14chain 'B' and (resid 113 through 122 )B113 - 122
15X-RAY DIFFRACTION15chain 'B' and (resid 123 through 132 )B123 - 132
16X-RAY DIFFRACTION16chain 'B' and (resid 133 through 145 )B133 - 145
17X-RAY DIFFRACTION17chain 'B' and (resid 146 through 161 )B146 - 161
18X-RAY DIFFRACTION18chain 'B' and (resid 162 through 177 )B162 - 177
19X-RAY DIFFRACTION19chain 'B' and (resid 178 through 191 )B178 - 191
20X-RAY DIFFRACTION20chain 'B' and (resid 192 through 202 )B192 - 202
21X-RAY DIFFRACTION21chain 'B' and (resid 203 through 219 )B203 - 219
22X-RAY DIFFRACTION22chain 'B' and (resid 220 through 231 )B220 - 231
23X-RAY DIFFRACTION23chain 'B' and (resid 232 through 247 )B232 - 247
24X-RAY DIFFRACTION24chain 'B' and (resid 248 through 264 )B248 - 264
25X-RAY DIFFRACTION25chain 'B' and (resid 265 through 273 )B265 - 273
26X-RAY DIFFRACTION26chain 'B' and (resid 274 through 281 )B274 - 281
27X-RAY DIFFRACTION27chain 'C' and (resid 113 through 145 )C113 - 145
28X-RAY DIFFRACTION28chain 'C' and (resid 146 through 177 )C146 - 177
29X-RAY DIFFRACTION29chain 'C' and (resid 178 through 202 )C178 - 202
30X-RAY DIFFRACTION30chain 'C' and (resid 203 through 273 )C203 - 273
31X-RAY DIFFRACTION31chain 'C' and (resid 274 through 281 )C274 - 281
32X-RAY DIFFRACTION32chain 'D' and (resid 113 through 145 )D113 - 145
33X-RAY DIFFRACTION33chain 'D' and (resid 146 through 161 )D146 - 161
34X-RAY DIFFRACTION34chain 'D' and (resid 162 through 191 )D162 - 191
35X-RAY DIFFRACTION35chain 'D' and (resid 192 through 247 )D192 - 247
36X-RAY DIFFRACTION36chain 'D' and (resid 248 through 281 )D248 - 281
37X-RAY DIFFRACTION37chain 'E' and (resid 113 through 161 )E113 - 161
38X-RAY DIFFRACTION38chain 'E' and (resid 162 through 191 )E162 - 191
39X-RAY DIFFRACTION39chain 'E' and (resid 192 through 281 )E192 - 281
40X-RAY DIFFRACTION40chain 'F' and (resid 113 through 145 )F113 - 145
41X-RAY DIFFRACTION41chain 'F' and (resid 146 through 191 )F146 - 191
42X-RAY DIFFRACTION42chain 'F' and (resid 192 through 281 )F192 - 281
43X-RAY DIFFRACTION43chain 'G' and (resid 113 through 122 )G113 - 122
44X-RAY DIFFRACTION44chain 'G' and (resid 123 through 132 )G123 - 132
45X-RAY DIFFRACTION45chain 'G' and (resid 133 through 145 )G133 - 145
46X-RAY DIFFRACTION46chain 'G' and (resid 146 through 177 )G146 - 177
47X-RAY DIFFRACTION47chain 'G' and (resid 178 through 191 )G178 - 191
48X-RAY DIFFRACTION48chain 'G' and (resid 192 through 202 )G192 - 202
49X-RAY DIFFRACTION49chain 'G' and (resid 203 through 219 )G203 - 219
50X-RAY DIFFRACTION50chain 'G' and (resid 220 through 231 )G220 - 231
51X-RAY DIFFRACTION51chain 'G' and (resid 232 through 261 )G232 - 261
52X-RAY DIFFRACTION52chain 'G' and (resid 262 through 273 )G262 - 273
53X-RAY DIFFRACTION53chain 'G' and (resid 274 through 281 )G274 - 281
54X-RAY DIFFRACTION54chain 'H' and (resid 113 through 161 )H113 - 161
55X-RAY DIFFRACTION55chain 'H' and (resid 162 through 177 )H162 - 177
56X-RAY DIFFRACTION56chain 'H' and (resid 178 through 203 )H178 - 203
57X-RAY DIFFRACTION57chain 'H' and (resid 204 through 219 )H204 - 219
58X-RAY DIFFRACTION58chain 'H' and (resid 220 through 261 )H220 - 261
59X-RAY DIFFRACTION59chain 'H' and (resid 262 through 281 )H262 - 281
60X-RAY DIFFRACTION60chain 'I' and (resid 113 through 122 )I113 - 122
61X-RAY DIFFRACTION61chain 'I' and (resid 123 through 132 )I123 - 132
62X-RAY DIFFRACTION62chain 'I' and (resid 133 through 161 )I133 - 161
63X-RAY DIFFRACTION63chain 'I' and (resid 162 through 177 )I162 - 177
64X-RAY DIFFRACTION64chain 'I' and (resid 178 through 191 )I178 - 191
65X-RAY DIFFRACTION65chain 'I' and (resid 192 through 231 )I192 - 231
66X-RAY DIFFRACTION66chain 'I' and (resid 232 through 247 )I232 - 247
67X-RAY DIFFRACTION67chain 'I' and (resid 248 through 261 )I248 - 261
68X-RAY DIFFRACTION68chain 'I' and (resid 262 through 281 )I262 - 281
69X-RAY DIFFRACTION69chain 'J' and (resid 113 through 132 )J113 - 132
70X-RAY DIFFRACTION70chain 'J' and (resid 133 through 145 )J133 - 145
71X-RAY DIFFRACTION71chain 'J' and (resid 146 through 161 )J146 - 161
72X-RAY DIFFRACTION72chain 'J' and (resid 162 through 177 )J162 - 177
73X-RAY DIFFRACTION73chain 'J' and (resid 178 through 191 )J178 - 191
74X-RAY DIFFRACTION74chain 'J' and (resid 192 through 219 )J192 - 219
75X-RAY DIFFRACTION75chain 'J' and (resid 220 through 247 )J220 - 247
76X-RAY DIFFRACTION76chain 'J' and (resid 248 through 261 )J248 - 261
77X-RAY DIFFRACTION77chain 'J' and (resid 262 through 281 )J262 - 281
78X-RAY DIFFRACTION78chain 'K' and (resid 113 through 144 )K113 - 144
79X-RAY DIFFRACTION79chain 'K' and (resid 145 through 177 )K145 - 177
80X-RAY DIFFRACTION80chain 'K' and (resid 178 through 202 )K178 - 202
81X-RAY DIFFRACTION81chain 'K' and (resid 203 through 281 )K203 - 281
82X-RAY DIFFRACTION82chain 'L' and (resid 113 through 122 )L113 - 122
83X-RAY DIFFRACTION83chain 'L' and (resid 123 through 132 )L123 - 132
84X-RAY DIFFRACTION84chain 'L' and (resid 133 through 161 )L133 - 161
85X-RAY DIFFRACTION85chain 'L' and (resid 162 through 177 )L162 - 177
86X-RAY DIFFRACTION86chain 'L' and (resid 178 through 219 )L178 - 219
87X-RAY DIFFRACTION87chain 'L' and (resid 220 through 231 )L220 - 231
88X-RAY DIFFRACTION88chain 'L' and (resid 232 through 247 )L232 - 247
89X-RAY DIFFRACTION89chain 'L' and (resid 248 through 273 )L248 - 273
90X-RAY DIFFRACTION90chain 'L' and (resid 274 through 281 )L274 - 281
91X-RAY DIFFRACTION91chain 'M' and (resid 113 through 132 )M113 - 132
92X-RAY DIFFRACTION92chain 'M' and (resid 133 through 145 )M133 - 145
93X-RAY DIFFRACTION93chain 'M' and (resid 146 through 161 )M146 - 161
94X-RAY DIFFRACTION94chain 'M' and (resid 162 through 191 )M162 - 191
95X-RAY DIFFRACTION95chain 'M' and (resid 192 through 231 )M192 - 231
96X-RAY DIFFRACTION96chain 'M' and (resid 232 through 264 )M232 - 264
97X-RAY DIFFRACTION97chain 'M' and (resid 265 through 281 )M265 - 281
98X-RAY DIFFRACTION98chain 'N' and (resid 113 through 145 )N113 - 145
99X-RAY DIFFRACTION99chain 'N' and (resid 146 through 177 )N146 - 177
100X-RAY DIFFRACTION100chain 'N' and (resid 178 through 191 )N178 - 191
101X-RAY DIFFRACTION101chain 'N' and (resid 192 through 231 )N192 - 231
102X-RAY DIFFRACTION102chain 'N' and (resid 232 through 247 )N232 - 247
103X-RAY DIFFRACTION103chain 'N' and (resid 248 through 281 )N248 - 281
104X-RAY DIFFRACTION104chain 'O' and (resid 113 through 122 )O113 - 122
105X-RAY DIFFRACTION105chain 'O' and (resid 123 through 132 )O123 - 132
106X-RAY DIFFRACTION106chain 'O' and (resid 133 through 145 )O133 - 145
107X-RAY DIFFRACTION107chain 'O' and (resid 146 through 161 )O146 - 161
108X-RAY DIFFRACTION108chain 'O' and (resid 162 through 191 )O162 - 191
109X-RAY DIFFRACTION109chain 'O' and (resid 192 through 202 )O192 - 202
110X-RAY DIFFRACTION110chain 'O' and (resid 203 through 261 )O203 - 261
111X-RAY DIFFRACTION111chain 'O' and (resid 262 through 273 )O262 - 273
112X-RAY DIFFRACTION112chain 'O' and (resid 274 through 281 )O274 - 281
113X-RAY DIFFRACTION113chain 'P' and (resid 113 through 122 )P113 - 122
114X-RAY DIFFRACTION114chain 'P' and (resid 123 through 132 )P123 - 132
115X-RAY DIFFRACTION115chain 'P' and (resid 133 through 145 )P133 - 145
116X-RAY DIFFRACTION116chain 'P' and (resid 146 through 161 )P146 - 161
117X-RAY DIFFRACTION117chain 'P' and (resid 162 through 177 )P162 - 177
118X-RAY DIFFRACTION118chain 'P' and (resid 178 through 191 )P178 - 191
119X-RAY DIFFRACTION119chain 'P' and (resid 192 through 202 )P192 - 202
120X-RAY DIFFRACTION120chain 'P' and (resid 203 through 231 )P203 - 231
121X-RAY DIFFRACTION121chain 'P' and (resid 232 through 247 )P232 - 247
122X-RAY DIFFRACTION122chain 'P' and (resid 248 through 264 )P248 - 264
123X-RAY DIFFRACTION123chain 'P' and (resid 265 through 273 )P265 - 273
124X-RAY DIFFRACTION124chain 'P' and (resid 274 through 281 )P274 - 281
125X-RAY DIFFRACTION125chain 'Q' and (resid 113 through 161 )Q113 - 161
126X-RAY DIFFRACTION126chain 'Q' and (resid 162 through 177 )Q162 - 177
127X-RAY DIFFRACTION127chain 'Q' and (resid 178 through 191 )Q178 - 191
128X-RAY DIFFRACTION128chain 'Q' and (resid 192 through 202 )Q192 - 202
129X-RAY DIFFRACTION129chain 'Q' and (resid 203 through 261 )Q203 - 261
130X-RAY DIFFRACTION130chain 'Q' and (resid 262 through 281 )Q262 - 281
131X-RAY DIFFRACTION131chain 'R' and (resid 113 through 132 )R113 - 132
132X-RAY DIFFRACTION132chain 'R' and (resid 133 through 177 )R133 - 177
133X-RAY DIFFRACTION133chain 'R' and (resid 178 through 191 )R178 - 191
134X-RAY DIFFRACTION134chain 'R' and (resid 192 through 231 )R192 - 231
135X-RAY DIFFRACTION135chain 'R' and (resid 232 through 281 )R232 - 281
136X-RAY DIFFRACTION136chain 'S' and (resid 113 through 154 )S113 - 154
137X-RAY DIFFRACTION137chain 'S' and (resid 155 through 202 )S155 - 202
138X-RAY DIFFRACTION138chain 'S' and (resid 203 through 261 )S203 - 261
139X-RAY DIFFRACTION139chain 'S' and (resid 262 through 281 )S262 - 281
140X-RAY DIFFRACTION140chain 'T' and (resid 113 through 122 )T113 - 122
141X-RAY DIFFRACTION141chain 'T' and (resid 123 through 145 )T123 - 145
142X-RAY DIFFRACTION142chain 'T' and (resid 146 through 161 )T146 - 161
143X-RAY DIFFRACTION143chain 'T' and (resid 162 through 177 )T162 - 177
144X-RAY DIFFRACTION144chain 'T' and (resid 178 through 191 )T178 - 191
145X-RAY DIFFRACTION145chain 'T' and (resid 192 through 202 )T192 - 202
146X-RAY DIFFRACTION146chain 'T' and (resid 203 through 219 )T203 - 219
147X-RAY DIFFRACTION147chain 'T' and (resid 220 through 231 )T220 - 231
148X-RAY DIFFRACTION148chain 'T' and (resid 232 through 261 )T232 - 261
149X-RAY DIFFRACTION149chain 'T' and (resid 262 through 273 )T262 - 273
150X-RAY DIFFRACTION150chain 'T' and (resid 274 through 281 )T274 - 281
151X-RAY DIFFRACTION151chain 'V' and (resid 113 through 132 )V113 - 132
152X-RAY DIFFRACTION152chain 'V' and (resid 133 through 145 )V133 - 145
153X-RAY DIFFRACTION153chain 'V' and (resid 146 through 161 )V146 - 161
154X-RAY DIFFRACTION154chain 'V' and (resid 162 through 177 )V162 - 177
155X-RAY DIFFRACTION155chain 'V' and (resid 178 through 202 )V178 - 202
156X-RAY DIFFRACTION156chain 'V' and (resid 203 through 231 )V203 - 231
157X-RAY DIFFRACTION157chain 'V' and (resid 232 through 247 )V232 - 247
158X-RAY DIFFRACTION158chain 'V' and (resid 248 through 264 )V248 - 264
159X-RAY DIFFRACTION159chain 'V' and (resid 265 through 281 )V265 - 281
160X-RAY DIFFRACTION160chain 'W' and (resid 113 through 122 )W113 - 122
161X-RAY DIFFRACTION161chain 'W' and (resid 123 through 132 )W123 - 132
162X-RAY DIFFRACTION162chain 'W' and (resid 133 through 145 )W133 - 145
163X-RAY DIFFRACTION163chain 'W' and (resid 146 through 161 )W146 - 161
164X-RAY DIFFRACTION164chain 'W' and (resid 162 through 177 )W162 - 177
165X-RAY DIFFRACTION165chain 'W' and (resid 178 through 192 )W178 - 192
166X-RAY DIFFRACTION166chain 'W' and (resid 193 through 203 )W193 - 203
167X-RAY DIFFRACTION167chain 'W' and (resid 204 through 219 )W204 - 219
168X-RAY DIFFRACTION168chain 'W' and (resid 220 through 247 )W220 - 247
169X-RAY DIFFRACTION169chain 'W' and (resid 248 through 261 )W248 - 261
170X-RAY DIFFRACTION170chain 'W' and (resid 262 through 281 )W262 - 281
171X-RAY DIFFRACTION171chain 'X' and (resid 113 through 122 )X113 - 122
172X-RAY DIFFRACTION172chain 'X' and (resid 123 through 145 )X123 - 145
173X-RAY DIFFRACTION173chain 'X' and (resid 146 through 161 )X146 - 161
174X-RAY DIFFRACTION174chain 'X' and (resid 162 through 177 )X162 - 177
175X-RAY DIFFRACTION175chain 'X' and (resid 178 through 191 )X178 - 191
176X-RAY DIFFRACTION176chain 'X' and (resid 192 through 219 )X192 - 219
177X-RAY DIFFRACTION177chain 'X' and (resid 220 through 247 )X220 - 247
178X-RAY DIFFRACTION178chain 'X' and (resid 248 through 273 )X248 - 273
179X-RAY DIFFRACTION179chain 'X' and (resid 274 through 281 )X274 - 281
180X-RAY DIFFRACTION180chain 'Y' and (resid 113 through 132 )Y113 - 132
181X-RAY DIFFRACTION181chain 'Y' and (resid 133 through 145 )Y133 - 145
182X-RAY DIFFRACTION182chain 'Y' and (resid 146 through 177 )Y146 - 177
183X-RAY DIFFRACTION183chain 'Y' and (resid 178 through 192 )Y178 - 192
184X-RAY DIFFRACTION184chain 'Y' and (resid 193 through 231 )Y193 - 231
185X-RAY DIFFRACTION185chain 'Y' and (resid 232 through 261 )Y232 - 261
186X-RAY DIFFRACTION186chain 'Y' and (resid 262 through 281 )Y262 - 281

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