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- PDB-7aqs: Crystal structure of E. coli DPS in space group P1 -

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Basic information

Entry
Database: PDB / ID: 7aqs
TitleCrystal structure of E. coli DPS in space group P1
ComponentsDNA protection during starvation protein
KeywordsDNA BINDING PROTEIN / DNA protection during starvation protein / an impurity of Colicin preparation / Iron
Function / homology
Function and homology information


DnaA-Dps complex / Oxidoreductases; Oxidizing metal ions / oxidoreductase activity, acting on metal ions / nucleoid / chromosome condensation / response to starvation / negative regulation of DNA-templated DNA replication initiation / ferric iron binding / intracellular iron ion homeostasis / DNA binding ...DnaA-Dps complex / Oxidoreductases; Oxidizing metal ions / oxidoreductase activity, acting on metal ions / nucleoid / chromosome condensation / response to starvation / negative regulation of DNA-templated DNA replication initiation / ferric iron binding / intracellular iron ion homeostasis / DNA binding / membrane / identical protein binding / cytoplasm
Similarity search - Function
DNA protection during starvation protein, gammaproteobacteria / Dps protein family signature 2. / Dps protein family signature 1. / DNA-binding protein Dps, conserved site / DNA-binding protein Dps / Ferritin/DPS protein domain / Ferritin-like domain / Ferritin-like / Ferritin-like superfamily
Similarity search - Domain/homology
: / DNA protection during starvation protein
Similarity search - Component
Biological speciesEscherichia coli (E. coli)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.8 Å
AuthorsJakob, R.P. / Pipercevic, J. / Righetto, R. / Goldie, K. / Stahlberg, H. / Maier, T. / Hiller, S.
CitationJournal: Biochim Biophys Acta Biomembr / Year: 2021
Title: Identification of a Dps contamination in Mitomycin-C-induced expression of Colicin Ia.
Authors: Pipercevic, J. / Jakob, R.P. / Righetto, R.D. / Goldie, K.N. / Stahlberg, H. / Maier, T. / Hiller, S.
History
DepositionOct 22, 2020Deposition site: PDBE / Processing site: PDBE
Revision 1.0Sep 1, 2021Provider: repository / Type: Initial release
Revision 1.1Jan 31, 2024Group: Data collection / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model / struct_ncs_dom_lim
Item: _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_label_asym_id ..._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: DNA protection during starvation protein
B: DNA protection during starvation protein
C: DNA protection during starvation protein
D: DNA protection during starvation protein
E: DNA protection during starvation protein
F: DNA protection during starvation protein
G: DNA protection during starvation protein
H: DNA protection during starvation protein
I: DNA protection during starvation protein
J: DNA protection during starvation protein
K: DNA protection during starvation protein
L: DNA protection during starvation protein
M: DNA protection during starvation protein
N: DNA protection during starvation protein
O: DNA protection during starvation protein
P: DNA protection during starvation protein
Q: DNA protection during starvation protein
R: DNA protection during starvation protein
S: DNA protection during starvation protein
T: DNA protection during starvation protein
U: DNA protection during starvation protein
V: DNA protection during starvation protein
W: DNA protection during starvation protein
X: DNA protection during starvation protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)455,12948
Polymers453,78924
Non-polymers1,34024
Water8,683482
1
A: DNA protection during starvation protein
B: DNA protection during starvation protein
C: DNA protection during starvation protein
D: DNA protection during starvation protein
E: DNA protection during starvation protein
F: DNA protection during starvation protein
G: DNA protection during starvation protein
H: DNA protection during starvation protein
I: DNA protection during starvation protein
J: DNA protection during starvation protein
K: DNA protection during starvation protein
L: DNA protection during starvation protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)227,56524
Polymers226,89512
Non-polymers67012
Water21612
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area46490 Å2
ΔGint-301 kcal/mol
Surface area58470 Å2
MethodPISA
2
M: DNA protection during starvation protein
N: DNA protection during starvation protein
O: DNA protection during starvation protein
P: DNA protection during starvation protein
Q: DNA protection during starvation protein
R: DNA protection during starvation protein
S: DNA protection during starvation protein
T: DNA protection during starvation protein
U: DNA protection during starvation protein
V: DNA protection during starvation protein
W: DNA protection during starvation protein
X: DNA protection during starvation protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)227,56524
Polymers226,89512
Non-polymers67012
Water21612
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area46660 Å2
ΔGint-303 kcal/mol
Surface area58170 Å2
MethodPISA
Unit cell
Length a, b, c (Å)91.550, 91.810, 172.640
Angle α, β, γ (deg.)91.170, 100.520, 119.920
Int Tables number1
Space group name H-MP1
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
11(chain A and (resid 13 through 167 or resid 201))
21(chain B and (resid 13 through 167 or resid 201))
31(chain C and (resid 13 through 167 or resid 201))
41(chain D and (resid 13 through 167 or resid 201))
51(chain E and (resid 13 through 167 or resid 201))
61chain F
71(chain G and (resid 13 through 167 or resid 201))
81(chain H and (resid 13 through 167 or resid 201))
91(chain I and (resid 13 through 167 or resid 201))
101chain J
111(chain K and (resid 13 through 167 or resid 201))
121(chain L and (resid 13 through 167 or resid 201))
131(chain M and (resid 13 through 167 or resid 201))
141chain N
151(chain O and (resid 13 through 167 or resid 201))
161(chain P and (resid 13 through 167 or resid 201))
171(chain Q and (resid 13 through 167 or resid 201))
181chain R
191(chain S and (resid 13 through 167 or resid 201))
201(chain T and (resid 13 through 167 or resid 201))
211(chain U and (resid 13 through 167 or resid 201))
221(chain V and (resid 13 through 167 or resid 201))
231(chain W and (resid 13 through 167 or resid 201))
241(chain X and (resid 13 through 167 or resid 201))

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
11ASNASNGLUGLU(chain A and (resid 13 through 167 or resid 201))AA13 - 16713 - 167
12FEFEFEFE(chain A and (resid 13 through 167 or resid 201))AY201
21ASNASNGLUGLU(chain B and (resid 13 through 167 or resid 201))BB13 - 16713 - 167
22FEFEFEFE(chain B and (resid 13 through 167 or resid 201))BZ201
31ASNASNGLUGLU(chain C and (resid 13 through 167 or resid 201))CC13 - 16713 - 167
32FEFEFEFE(chain C and (resid 13 through 167 or resid 201))CAA201
41ASNASNGLUGLU(chain D and (resid 13 through 167 or resid 201))DD13 - 16713 - 167
42FEFEFEFE(chain D and (resid 13 through 167 or resid 201))DBA201
51ASNASNGLUGLU(chain E and (resid 13 through 167 or resid 201))EE13 - 16713 - 167
52FEFEFEFE(chain E and (resid 13 through 167 or resid 201))ECA201
61ASNASNGLUGLUchain FFF13 - 16713 - 167
71ASNASNGLUGLU(chain G and (resid 13 through 167 or resid 201))GG13 - 16713 - 167
72FEFEFEFE(chain G and (resid 13 through 167 or resid 201))GEA201
81ASNASNGLUGLU(chain H and (resid 13 through 167 or resid 201))HH13 - 16713 - 167
82FEFEFEFE(chain H and (resid 13 through 167 or resid 201))HFA201
91ASNASNGLUGLU(chain I and (resid 13 through 167 or resid 201))II13 - 16713 - 167
92FEFEFEFE(chain I and (resid 13 through 167 or resid 201))IGA201
101ASNASNGLUGLUchain JJJ13 - 16713 - 167
111ASNASNGLUGLU(chain K and (resid 13 through 167 or resid 201))KK13 - 16713 - 167
112FEFEFEFE(chain K and (resid 13 through 167 or resid 201))KIA201
121ASNASNGLUGLU(chain L and (resid 13 through 167 or resid 201))LL13 - 16713 - 167
122FEFEFEFE(chain L and (resid 13 through 167 or resid 201))LJA201
131ASNASNGLUGLU(chain M and (resid 13 through 167 or resid 201))MM13 - 16713 - 167
132FEFEFEFE(chain M and (resid 13 through 167 or resid 201))MKA201
141ASNASNGLUGLUchain NNN13 - 16713 - 167
151ASNASNGLUGLU(chain O and (resid 13 through 167 or resid 201))OO13 - 16713 - 167
152FEFEFEFE(chain O and (resid 13 through 167 or resid 201))OMA201
161ASNASNGLUGLU(chain P and (resid 13 through 167 or resid 201))PP13 - 16713 - 167
162FEFEFEFE(chain P and (resid 13 through 167 or resid 201))PNA201
171ASNASNGLUGLU(chain Q and (resid 13 through 167 or resid 201))QQ13 - 16713 - 167
172FEFEFEFE(chain Q and (resid 13 through 167 or resid 201))QOA201
181ASNASNGLUGLUchain RRR13 - 16713 - 167
191ASNASNGLUGLU(chain S and (resid 13 through 167 or resid 201))SS13 - 16713 - 167
192FEFEFEFE(chain S and (resid 13 through 167 or resid 201))SQA201
201ASNASNGLUGLU(chain T and (resid 13 through 167 or resid 201))TT13 - 16713 - 167
202FEFEFEFE(chain T and (resid 13 through 167 or resid 201))TRA201
211ASNASNGLUGLU(chain U and (resid 13 through 167 or resid 201))UU13 - 16713 - 167
212FEFEFEFE(chain U and (resid 13 through 167 or resid 201))USA201
221ASNASNGLUGLU(chain V and (resid 13 through 167 or resid 201))VV13 - 16713 - 167
222FEFEFEFE(chain V and (resid 13 through 167 or resid 201))VTA201
231ASNASNGLUGLU(chain W and (resid 13 through 167 or resid 201))WW13 - 16713 - 167
232FEFEFEFE(chain W and (resid 13 through 167 or resid 201))WUA201
241ASNASNGLUGLU(chain X and (resid 13 through 167 or resid 201))XX13 - 16713 - 167
242FEFEFEFE(chain X and (resid 13 through 167 or resid 201))XVA201

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Components

#1: Protein ...
DNA protection during starvation protein


Mass: 18907.875 Da / Num. of mol.: 24 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Variant: TG1 / Strain: K12
References: UniProt: P0ABT2, Oxidoreductases; Oxidizing metal ions
#2: Chemical...
ChemComp-FE / FE (III) ION / Iron


Mass: 55.845 Da / Num. of mol.: 24 / Source method: obtained synthetically / Formula: Fe
#3: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 482 / Source method: isolated from a natural source / Formula: H2O
Has ligand of interestN

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Experimental details

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Experiment

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

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Sample preparation

CrystalDensity Matthews: 2.8 Å3/Da / Density % sol: 56.01 %
Crystal growTemperature: 293 K / Method: vapor diffusion, sitting drop
Details: 0.1 M HEPES pH 7.0, 6.73 % w/v PEG 5000 MME and 0.06 M KCl

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: SLS / Beamline: X06DA / Wavelength: 0.979399 Å
DetectorType: DECTRIS PILATUS 2M-F / Detector: PIXEL / Date: Aug 6, 2016
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.979399 Å / Relative weight: 1
ReflectionResolution: 2.8→45.895 Å / Num. obs: 116604 / % possible obs: 99.68 % / Redundancy: 10.7 % / Biso Wilson estimate: 33 Å2 / CC1/2: 0.988 / Rrim(I) all: 0.397 / Net I/σ(I): 6.4
Reflection shellResolution: 2.8→2.87 Å / Redundancy: 10.6 % / Mean I/σ(I) obs: 1.4 / Num. unique obs: 11605 / CC1/2: 0.744 / Rrim(I) all: 1.676 / % possible all: 99.18

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Processing

Software
NameVersionClassification
PHENIX1.13_2998refinement
PDB_EXTRACT3.25data extraction
XDSdata reduction
XSCALEdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 1DPS

1dps


Resolution: 2.8→45.895 Å / SU ML: 0.36 / Cross valid method: FREE R-VALUE / σ(F): 1.96 / Phase error: 30.14 / Stereochemistry target values: ML
RfactorNum. reflection% reflection
Rfree0.2433 3511 3.01 %
Rwork0.2017 113092 -
obs0.203 116603 99.69 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso max: 136.3 Å2 / Biso mean: 41.1987 Å2 / Biso min: 4.55 Å2
Refinement stepCycle: final / Resolution: 2.8→45.895 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms29740 0 24 484 30248
Biso mean--20.3 22.07 -
Num. residues----3756
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDRmsType
11A17633X-RAY DIFFRACTION7.828TORSIONAL
12B17633X-RAY DIFFRACTION7.828TORSIONAL
13C17633X-RAY DIFFRACTION7.828TORSIONAL
14D17633X-RAY DIFFRACTION7.828TORSIONAL
15E17633X-RAY DIFFRACTION7.828TORSIONAL
16F17633X-RAY DIFFRACTION7.828TORSIONAL
17G17633X-RAY DIFFRACTION7.828TORSIONAL
18H17633X-RAY DIFFRACTION7.828TORSIONAL
19I17633X-RAY DIFFRACTION7.828TORSIONAL
110J17633X-RAY DIFFRACTION7.828TORSIONAL
111K17633X-RAY DIFFRACTION7.828TORSIONAL
112L17633X-RAY DIFFRACTION7.828TORSIONAL
113M17633X-RAY DIFFRACTION7.828TORSIONAL
114N17633X-RAY DIFFRACTION7.828TORSIONAL
115O17633X-RAY DIFFRACTION7.828TORSIONAL
116P17633X-RAY DIFFRACTION7.828TORSIONAL
117Q17633X-RAY DIFFRACTION7.828TORSIONAL
118R17633X-RAY DIFFRACTION7.828TORSIONAL
119S17633X-RAY DIFFRACTION7.828TORSIONAL
120T17633X-RAY DIFFRACTION7.828TORSIONAL
121U17633X-RAY DIFFRACTION7.828TORSIONAL
122V17633X-RAY DIFFRACTION7.828TORSIONAL
123W17633X-RAY DIFFRACTION7.828TORSIONAL
124X17633X-RAY DIFFRACTION7.828TORSIONAL
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection Rwork% reflection obs (%)
2.8-2.83830.34111570.3003441298
2.8383-2.87890.32481400.29014607100
2.8789-2.92190.33961350.2794470100
2.9219-2.96750.32731540.26434579100
2.9675-3.01610.3051570.26544433100
3.0161-3.06810.31761250.25784662100
3.0681-3.12390.35421590.26854460100
3.1239-3.1840.30941550.27284537100
3.184-3.2490.27061290.23854491100
3.249-3.31960.28691590.23174526100
3.3196-3.39680.28521240.23044598100
3.3968-3.48170.28511390.21344436100
3.4817-3.57580.23661330.20764575100
3.5758-3.6810.241450.20034582100
3.681-3.79970.21561070.19424568100
3.7997-3.93550.22591470.1814458100
3.9355-4.0930.21471180.17214565100
4.093-4.27910.18131540.15344524100
4.2791-4.50450.17641470.14934517100
4.5045-4.78650.1721150.1494577100
4.7865-5.15560.17831710.14634485100
5.1556-5.67360.22861590.18074541100
5.6736-6.49260.25551550.20654492100
6.4926-8.17240.19831090.17414567100
8.1724-45.8950.19361180.1715443097
Refinement TLS params.

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

IDL11 (°2)L12 (°2)L13 (°2)L22 (°2)L23 (°2)L33 (°2)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T11 (Å2)T12 (Å2)T13 (Å2)T22 (Å2)T23 (Å2)T33 (Å2)Origin x (Å)Origin y (Å)Origin z (Å)
11.088-0.3294-1.57313.7652-0.47643.2941-0.02880.5672-0.3037-0.8603-0.00040.4016-0.1393-0.51190.15390.5999-0.0905-0.18850.3704-0.26490.2489-46.8509-99.8359-24.1791
20.9863-0.33970.07620.50440.15040.48810.02460.3045-0.057-0.22740.04960.47330.07550.1766-0.2246-0.0261-0.1855-0.22030.2046-0.08040.5934-61.2258-92.3638-9.4101
30.46740.7285-1.10841.2779-1.34913.60530.04880.1084-0.19450.0868-0.1985-0.20030.14650.29030.17050.1519-0.11210.00590.4292-0.12660.8056-70.8403-78.611511.1083
40.5841-0.145-0.2760.88090.66381.1385-0.08950.09260.0033-0.18730.17130.5117-0.1967-0.05290.02580.1665-0.0367-0.1240.20150.01940.4166-58.6004-87.8658-5.6451
50.8361-0.0320.19610.06-0.03750.08420.08770.1639-0.0652-0.097-0.11140.55340.2168-0.0360.0250.0267-0.1313-0.10190.23350.0220.9137-70.4149-91.75110.7583
63.4112-0.2739-1.76722.53620.83032.40360.0740.1296-0.0264-0.3101-0.12660.4519-0.13790.0330.14360.003-0.1185-0.08150.04050.03910.4756-58.6858-97.70252.9947
70.1655-0.17350.06790.97880.260.2434-0.1171-0.1026-0.14310.17110.0991-0.5954-0.13740.11110.0335-0.02040.0097-0.22740.2591-0.03610.6801-4.1585-77.383118.3089
81.7821-1.34232.09242.4157-3.20574.3430.32670.0944-0.1589-0.0619-0.17140.04480.4110.0517-0.07020.3067-0.1298-0.24070.3902-0.08590.4168-23.7454-54.507129.1605
90.5555-0.70060.2491.0954-0.70691.1468-0.1063-0.1868-0.00880.50340.137-0.3278-0.2198-0.05610.12690.0885-0.0932-0.21230.159-0.03340.4357-12.6187-72.612820.889
101.25980.3098-0.18522.00750.52621.4154-0.074-0.21210.197-0.00310.0793-0.354-0.12830.0395-0.04250.1544-0.0322-0.11280.18450.00040.2737-9.9732-61.454417.6518
110.4952-0.1132-0.10230.46420.35130.6704-0.0417-0.02970.21760.01660.03520.5797-0.044-0.08190.06440.09930.0273-0.23840.22960.03060.9239-68.8726-69.7169-4.1415
124.8633.2763-1.73043.2129-2.11011.4990.42-0.64450.12580.3875-0.36520.14150.2328-0.0427-0.04490.5416-0.1306-0.34460.5478-0.02150.3471-45.8185-83.7361-21.5572
130.4059-0.5958-0.55331.37210.32331.1005-0.04320.09150.3419-0.3270.05890.39890.0777-0.08060.06340.0297-0.0439-0.160.23750.03680.6013-57.97-74.0032-5.2394
140.38160.28350.52110.38790.18541.04870.01650.28130.1136-0.4354-0.15340.5426-0.0381-0.27620.07280.16930.0059-0.51270.26830.14120.3547-58.0109-69.7885-15.6559
151.5846-1.4795-0.61612.6210.62010.95490.1348-0.3820.060.5409-0.0242-0.2654-0.0595-0.0601-0.10340.3777-0.0985-0.07990.3288-0.06170.1589-21.4372-68.795239.4878
160.6875-0.7832-0.37672.26071.40660.911-0.0456-0.156-0.10690.5392-0.1001-0.06470.1310.05120.04650.3268-0.0542-0.09240.28390.03850.1922-20.6519-78.454528.934
171.15680.0256-0.04591.0313-0.97040.95030.1003-0.47240.07460.64650.1855-0.0668-0.05010.02740.08980.30420.001-0.34850.3040.1137-0.0106-18.8286-84.11336.8732
180.75850.4943-0.42112.3121-1.62411.7308-0.1224-0.0224-0.3384-0.2941-0.0207-0.28250.21550.07070.14490.1544-0.03060.02480.1844-0.01340.3135-28.4029-109.0353-3.3611
198.5901-5.80124.20923.9201-2.84292.06160.03-0.4065-0.44810.09640.30090.1243-0.254-0.0146-0.18140.31930.01990.05470.3049-0.00770.2333-27.7471-81.6021-21.1004
200.27570.0541-0.1363.1338-2.16231.5096-0.19710.10640.0072-0.45340.17170.02440.1728-0.1281-0.07730.16790.0014-0.04860.1214-0.03150.2562-30.5913-96.8724-4.8028
211.4470.4502-0.31531.5197-0.12281.4745-0.13610.1788-0.2867-0.6404-0.0014-0.11160.2523-0.09670.00530.2502-0.0557-0.08880.1817-0.0430.1577-33.8959-99.1269-15.2297
221.03380.8861-0.42571.7057-1.11450.7793-0.122-0.2690.21930.6452-0.00330.2295-0.0417-0.206-0.08230.54440.02240.25790.3734-0.1150.4437-54.2991-67.189838.6094
230.5569-0.0562-0.76470.7678-0.32541.11890.1868-0.21250.21440.4929-0.11310.4159-0.13320.1372-0.03770.318-0.05540.08620.3082-0.09450.3436-48.1662-61.062529.6815
241.2997-0.07910.66071.7245-0.02691.41230.0155-0.26240.15650.6690.03450.0603-0.05940.0796-0.13250.4452-0.01810.06660.2827-0.09510.2275-40.7173-57.725436.5011
254.6364-0.02850.9550.70630.79443.61170.40710.43110.0401-0.14680.1318-0.03560.29050.0586-0.13540.3712-0.09680.13840.21150.08940.0613-12.2365-77.3157-24.2278
261.26551.0655-0.62924.3502-2.62262.8769-0.0994-0.0982-0.0687-0.3839-0.0683-0.56710.09280.05660.13360.0944-0.00950.05930.1738-0.09410.2675-12.9707-90.662-8.3803
271.4830.86821.7151.49961.22127.14440.0934-0.3201-0.00790.13730.04550.0055-0.3958-0.0341-0.17630.09280.1163-0.07270.27250.08140.4305-20.6339-105.61111.9701
280.25360.7771-0.76272.3648-2.122.66180.0812-0.125-0.03870.00410.041-0.0261-0.04190.07390.03910.11190.0127-0.00840.19240.05570.2482-19.1406-88.7633-2.8825
291.27480.41750.39250.9322-0.35391.0546-0.09950.0723-0.2295-0.17230.1335-0.68890.2633-0.0185-0.03240.041-0.03420.07450.1879-0.01220.5805-9.458-97.4528-1.3023
302.21450.05130.20181.5585-0.67341.287-0.2488-0.04080.221-0.10620.1797-0.4132-0.138-0.208-0.04170.0130.0215-0.08440.162-0.07530.3556-10.547-86.5955.5227
310.92440.8844-0.88432.3794-1.42661.5622-0.06680.08460.3030.10340.1810.3916-0.043-0.1798-0.08670.17920.008-0.01290.1745-0.01140.6172-55.1389-48.385417.4928
320.20960.214-0.06681.32160.13550.8864-0.0114-0.15340.06580.21370.05250.47070.2422-0.08280.20830.0433-0.00420.0980.242-0.05360.764-56.4262-60.420721.2232
331.83390.2975-0.29751.3905-0.7871.78290.00420.15230.13310.44760.01520.7816-0.3131-0.1665-0.07710.04290.06070.06450.2054-0.05180.8572-65.9892-61.289116.6584
343.55070.24382.16420.35850.24061.43620.0656-0.051-0.29510.15490.02280.46540.137-0.0945-0.10910.1532-0.0478-0.0150.20230.0190.4196-54.768-106.972817.362
352.41340.50720.80550.85060.12130.42630.0746-0.0885-0.41620.2793-0.09360.02860.06440.0797-0.0820.2045-0.0511-0.04310.1954-0.00250.3022-42.3621-100.650919.9267
361.5162-0.323-0.15031.77660.49532.20510.0406-0.0952-0.21260.3503-0.09840.10760.16320.02430.03220.1555-0.0167-0.0180.07560.04750.2395-39.5049-110.005918.2282
372.5980.47921.7320.14360.44981.78580.10850.02570.3794-0.42220.04360.3636-0.0981-0.0830.28880.22560.0246-0.31170.20420.15520.5039-42.0068-51.8932-12.5994
382.8631-0.2473-2.90540.13270.2983.6919-0.45510.06310.074-0.10120.22110.0226-0.1947-0.45390.38740.3221-0.0205-0.15750.15890.01550.4015-22.366-48.542312.0692
391.05910.14710.70060.08770.050.49890.0129-0.0160.0879-0.1856-0.02170.1626-0.01740.11510.01580.2638-0.0133-0.08340.17960.03890.4705-36.1246-54.2139-5.1253
402.34140.36390.441.40990.23311.1199-0.05620.32740.5205-0.0736-0.0560.3591-0.19750.03760.12290.1486-0.0216-0.12920.1265-0.02140.5042-38.6363-45.34352.374
413.18590.05681.28990.55210.23890.70760.1268-0.548-0.19070.7478-0.14020.26580.1799-0.0627-0.10620.5695-0.114-0.01340.26170.11380.1394-39.3585-96.870638.8383
420.8946-0.08091.09571.1162-0.41381.85590.0427-0.3222-0.09230.3767-0.07670.2842-0.0201-0.1072-0.02540.3267-0.05760.10420.27440.01170.2683-47.6416-94.509129.5665
431.88960.52430.43162.04560.68291.99240.2348-0.3633-0.08150.6879-0.07810.45650.1107-0.1507-0.2030.4756-0.06250.13650.30240.04260.3148-54.4619-89.662336.0768
441.30530.3825-0.88751.76230.21621.3508-0.0271-0.2376-0.0097-0.1416-0.50310.0652-0.3602-0.29830.27890.0883-0.135-0.12310.2091-0.23510.3265-6.7549-48.23837.3706
455.46130.73623.141.15190.55052.90690.0580.16950.0579-0.1373-0.0192-0.1626-0.07550.26440.010.3022-0.0501-0.05330.21260.04960.32-18.7688-56.1966-7.7071
460.3673-0.7083-0.85744.1575.03266.09260.0741-0.20940.00270.94410.3392-0.67410.2736-0.1983-0.38290.5177-0.0444-0.0630.36320.04520.4058-38.6916-67.0632-21.306
471.35240.59440.71540.56350.31230.8671-0.11330.0440.0081-0.1510.1013-0.1212-0.0792-0.0287-0.08190.1995-0.0514-0.04990.25510.00220.3175-24.0221-59.212-5.6964
482.4229-0.23280.49921.8838-0.54872.3628-0.23250.62850.4038-0.47390.1660.0611-0.0840.3177-0.0450.3091-0.06210.01690.17470.02410.1667-22.8008-61.8491-19.441
493.30350.38451.17942.75610.36373.5093-0.00250.10760.0315-0.2938-0.0005-0.1320.19740.3415-0.07480.23670.03980.06790.1141-0.00810.2936-17.4702-69.6126-10.0541
501.8331-0.8986-1.03632.08661.27731.0349-0.04330.2173-0.2519-0.4799-0.06640.25590.0039-0.12730.0410.4365-0.0104-0.07230.35770.05260.3231-22.9615-107.8678-97.2767
511.3504-0.5369-1.13671.12630.94561.9992-0.20350.0084-0.08940.00350.09440.40910.337-0.05720.10510.4066-0.03920.07190.35750.00720.3509-24.4088-100.1433-85.3904
521.8928-0.0402-0.1512.0007-0.56612.18390.0185-0.0166-0.2267-0.3648-0.0830.37380.1049-0.14360.08450.3061-0.0105-0.01410.27840.01270.5359-31.0949-107.2765-83.8227
532.03470.8102-1.80642.6769-1.65942.27460.1272-0.1084-0.1916-0.06470.3288-0.01570.04610.2704-0.3050.35730.05820.11860.3651-0.01050.881735.4915-104.6411-72.6787
544.0059-4.1624-2.50915.20153.08773.60120.2636-0.337-0.0004-0.07360.1046-0.7871-0.13060.2243-0.23340.31130.0118-0.05550.27940.05050.677828.0591-85.9185-63.0605
552.2626-3.32764.39034.9332-6.54388.71280.4918-0.1583-0.00720.1757-0.419-0.50130.43610.0416-0.10940.4723-0.1025-0.0390.48660.02150.634110.6449-68.0575-54.6829
562.2631-3.098-1.62266.05282.57921.9090.07970.0381-0.0164-0.0495-0.0912-0.4731-0.13-0.00410.05620.2882-0-0.03430.3463-0.00770.552217.5315-83.9147-65.3716
572.1437-1.0004-0.52332.04120.14590.7667-0.0804-0.3960.00450.6106-0.1291-0.48030.02510.18780.1660.3964-0.0107-0.1640.46070.00540.644227.7236-81.8493-54.8724
581.1783-0.33110.10923.60770.45771.8701-0.1213-0.09460.0974-0.0280.2006-0.8780.00260.1994-0.08770.31710.00110.03150.33520.07680.607124.6054-75.7155-69.304
591.7845-0.7145-1.00762.07521.44343.16860.13470.2861-0.1018-0.3037-0.22160.5731-0.3637-0.43860.13520.33550.0005-0.04460.28420.03550.4588-34.4028-83.2347-88.0419
608.90847.0692-5.97515.8051-4.76464.48070.5124-0.46820.64760.0849-0.03470.4644-0.14430.536-0.37020.68060.0509-0.0630.5202-0.11080.3283-11.3259-97.2658-105.494
612.0501-1.0014-1.752.14771.75932.9470.25250.16750.2235-0.3887-0.140.1865-0.2859-0.0998-0.06810.36240.0452-0.00060.30980.0320.3115-23.5587-87.5559-89.1759
621.6099-0.3525-0.0032.31620.36011.74620.15050.3412-0.0398-0.5508-0.10670.5627-0.0949-0.05250.030.44930.0115-0.08530.35870.03980.2909-23.5724-83.301-99.5336
631.6731-1.4338-0.68362.21550.56450.9258-0.1642-0.53910.05030.58140.0881-0.2229-0.02690.1007-0.00220.5779-0.0106-0.13230.5594-0.010.381112.9231-82.3403-44.4145
640.7329-0.0438-0.33732.02061.42711.4047-0.1342-0.2071-0.09020.57670.0797-0.50850.18020.0440.10090.59090.0144-0.10090.36970.05470.375813.6898-92.0036-54.9101
651.9521-0.4199-0.07512.30860.42211.9579-0.1929-0.3858-0.16430.79630.2801-0.28410.25830.2585-0.10120.51330.0279-0.13120.4270.03090.370415.5322-97.6408-46.9183
662.1224-1.60630.56963.85372.21015.0204-0.08210.46450.09640.5088-0.41520.14660.370.26530.59010.39240.0037-0.15460.332-0.00840.33816.3363-132.7185-76.9564
670.9380.6788-0.30264.4368-1.7421.9869-0.1130.0734-0.3482-0.59150.0186-0.22170.1894-0.12990.05430.39840.09050.15270.3503-0.00820.4445.8782-117.993-91.8863
688.389-3.7941.64611.7189-0.73710.32780.1347-0.2327-0.2951-0.31880.17040.1322-0.14980.2413-0.40040.7920.06180.05960.5099-0.03610.32036.7241-95.1248-105.0221
690.560.00860.23511.9243-1.11561.221-0.1257-0.0849-0.0978-0.25490.311-0.1826-0.0141-0.2071-0.10430.51450.05080.04890.3382-0.02180.32492.6078-107.7328-89.6847
701.3804-0.05060.67910.1613-0.50681.82560.16680.2175-0.238-0.5070.1046-0.1968-0.04480.12430.37940.69210.03270.21360.3917-0.09150.26355.8274-114.1483-100.1171
712.2667-0.51450.96223.3434-1.23522.552-0.0291-0.0063-0.2562-0.5687-0.0844-0.22890.1809-0.3280.12630.39340.03210.01960.4021-0.08590.3563-6.4294-112.3689-94.5142
720.38740.5565-0.39661.2894-0.67360.46870.04910.0233-0.02050.34610.22910.1170.0983-0.1499-0.00870.60550.04890.18380.44050.03120.2289-19.9375-80.731-45.3733
731.03180.624-0.52421.6741-0.24520.2935-0.07-0.2680.14030.192-0.01810.0544-0.04950.05280.09370.50770.01230.0690.3320.00450.2694-13.7909-74.6055-54.2771
741.0619-0.04990.15652.1764-0.56881.46650.0482-0.21020.15570.65180.05360.0076-0.2414-0.0946-0.0920.54590.02190.04070.3953-0.02040.228-6.344-71.2349-47.4369
750.70250.6133-0.27770.7486-0.62670.63920.05310.2537-0.2596-0.4412-0.0121-0.5291-0.14840.09150.21230.58760.01190.36290.4065-0.00390.589121.4778-99.9777-96.2874
760.26290.40741.01380.66311.60724.31040.10080.1063-0.3585-0.1564-0.3893-0.2819-0.40970.5160.20750.23510.0372-0.00410.53660.00770.54313.7924-119.0789-71.9078
771.30381.0091-1.54981.9114-1.78852.94150.04880.2058-0.1132-0.2302-0.1627-0.48950.07720.08350.02140.34690.0850.09660.37030.01340.417415.3044-102.2632-86.8462
781.4352-0.0339-0.31291.2375-0.26432.15640.0020.3567-0.6099-0.5695-0.1782-0.33460.51860.05810.08120.58330.03180.22920.3656-0.08480.588421.3791-117.4806-88.9207
792.7480.5416-0.11062.11730.70721.2105-0.101-0.0751-0.0741-0.25530.0166-0.93480.03630.55370.08660.38040.05480.09260.37950.08820.5627.0357-108.4056-81.2125
802.20510.2639-0.19490.84040.76740.80860.0782-0.0093-0.0091-0.3075-0.0487-0.5807-0.08130.1995-0.01810.27790.06540.08460.35290.04570.56724.5229-99.1094-79.9772
811.42691.5439-1.37272.5687-1.93321.5121-0.07870.05280.24710.15520.21740.20280.0717-0.1395-0.17830.42790.04680.08540.3285-0.01260.3722-20.7197-61.8447-66.4337
820.84661.027-0.23761.9135-0.27160.0448-0.0167-0.0870.37130.2028-0.06060.37840.09110.0554-0.03230.47070.03710.13050.3385-0.02010.3106-21.4937-75.8764-64.1495
831.69480.25880.01141.4497-0.51161.6188-0.06390.03640.01180.44660.130.4779-0.0938-0.2284-0.10870.33160.05290.13320.3174-0.00370.3438-30.997-73.7004-66.0583
843.46040.44751.65970.85530.09451.36150.15390.0168-0.04360.1449-0.06040.26380.1361-0.0373-0.18180.3281-0.02290.08280.25320.01590.3568-20.4519-120.5791-66.6407
852.8418-0.45831.1620.1465-0.26340.68840.01420.1619-0.12640.17030.0475-0.0457-0.11820.1069-0.08090.40560.04850.06850.33610.0570.4325-7.9585-114.207-63.9647
861.6967-0.27970.81231.90210.07782.14140.2839-0.0605-0.29850.114-0.1131-0.11710.3629-0.1073-0.11910.3836-0.01630.06540.28990.0620.3626-5.0934-123.5404-65.6628
870.4257-0.24250.24421.35170.18811.5939-0.02330.11-0.0147-0.0330.20.20090.089-0.0452-0.12330.6843-0.0334-0.14720.4560.19370.0246-17.1808-71.319-107.7095
884.80470.37053.4681.30670.60093.648-0.36060.16310.4874-0.3861-0.1461-0.0898-0.0123-0.0250.32190.44640.03790.08090.28980.06820.2432-4.0759-63.1455-92.6627
895.6549-1.0651-5.70340.20221.09365.9626-0.2056-0.19-0.18930.1930.1324-0.38880.1074-0.7030.03460.53330.1260.08160.30580.09270.470912.101-62.066-71.783
901.20230.65051.35140.40330.66881.7418-0.00180.0654-0.0272-0.31510.094-0.1535-0.07310.011-0.04110.42060.06510.03910.3665-0.00560.2001-2.7937-69.3907-87.0131
912.554-0.51311.17361.6523-0.0864.8066-0.08160.46860.4855-0.26250.1349-0.6517-0.30760.26680.13710.344-0.02120.09310.39360.11030.43477.325-56.5002-88.9833
924.6021.57671.8482.59580.67811.6178-0.1669-0.03890.3488-0.05740.0260.2583-0.0044-0.15680.1540.29160.03950.09770.2840.01160.3481-7.2048-59.7786-81.0503
933.68020.97551.25930.67720.16331.29860.2048-0.4999-0.17620.4657-0.11740.00220.1713-0.0087-0.19840.73150.06970.0020.37990.04160.3715-4.8986-110.4045-44.9051
941.70930.23171.27040.77560.58561.22280.0399-0.3983-0.05760.3347-0.05050.1754-0.0299-0.1024-0.04940.40980.00930.10540.41630.09030.3233-13.3431-105.9132-55.5349
951.51870.3870.31322.18050.44711.54950.2718-0.26340.08580.621-0.07340.29210.022-0.075-0.12760.52560.00370.17990.33030.02210.2645-19.3717-104.8749-47.7074
962.24910.90061.7211.01030.68622.8492-0.13230.148-0.1103-0.06140.1051-0.4979-0.15010.31760.04710.31130.0240.13560.35070.03630.476919.2487-67.5945-86.8971
971.2960.49010.22781.01870.01340.19090.0630.235-0.1704-0.27350.1025-0.24750.08570.0415-0.00910.4330.00830.14360.3924-0.00880.27877.8415-76.0607-90.9397
981.5901-0.2958-0.31952.35010.14111.7728-0.14780.39990.2212-0.4764-0.0101-0.63230.13740.20870.06750.45660.02310.18740.39770.05840.394713.9251-77.0695-98.7547
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 12 through 22 )A12 - 22
2X-RAY DIFFRACTION2chain 'A' and (resid 23 through 52 )A23 - 52
3X-RAY DIFFRACTION3chain 'A' and (resid 53 through 58 )A53 - 58
4X-RAY DIFFRACTION4chain 'A' and (resid 59 through 101 )A59 - 101
5X-RAY DIFFRACTION5chain 'A' and (resid 102 through 138 )A102 - 138
6X-RAY DIFFRACTION6chain 'A' and (resid 139 through 167 )A139 - 167
7X-RAY DIFFRACTION7chain 'B' and (resid 12 through 52 )B12 - 52
8X-RAY DIFFRACTION8chain 'B' and (resid 53 through 58 )B53 - 58
9X-RAY DIFFRACTION9chain 'B' and (resid 59 through 101 )B59 - 101
10X-RAY DIFFRACTION10chain 'B' and (resid 102 through 167 )B102 - 167
11X-RAY DIFFRACTION11chain 'C' and (resid 11 through 52 )C11 - 52
12X-RAY DIFFRACTION12chain 'C' and (resid 53 through 58 )C53 - 58
13X-RAY DIFFRACTION13chain 'C' and (resid 59 through 94 )C59 - 94
14X-RAY DIFFRACTION14chain 'C' and (resid 95 through 167 )C95 - 167
15X-RAY DIFFRACTION15chain 'D' and (resid 12 through 52 )D12 - 52
16X-RAY DIFFRACTION16chain 'D' and (resid 53 through 94 )D53 - 94
17X-RAY DIFFRACTION17chain 'D' and (resid 95 through 167 )D95 - 167
18X-RAY DIFFRACTION18chain 'E' and (resid 9 through 52 )E9 - 52
19X-RAY DIFFRACTION19chain 'E' and (resid 53 through 58 )E53 - 58
20X-RAY DIFFRACTION20chain 'E' and (resid 59 through 94 )E59 - 94
21X-RAY DIFFRACTION21chain 'E' and (resid 95 through 167 )E95 - 167
22X-RAY DIFFRACTION22chain 'F' and (resid 13 through 52 )F13 - 52
23X-RAY DIFFRACTION23chain 'F' and (resid 53 through 101 )F53 - 101
24X-RAY DIFFRACTION24chain 'F' and (resid 102 through 167 )F102 - 167
25X-RAY DIFFRACTION25chain 'G' and (resid 9 through 22 )G9 - 22
26X-RAY DIFFRACTION26chain 'G' and (resid 23 through 52 )G23 - 52
27X-RAY DIFFRACTION27chain 'G' and (resid 53 through 58 )G53 - 58
28X-RAY DIFFRACTION28chain 'G' and (resid 59 through 94 )G59 - 94
29X-RAY DIFFRACTION29chain 'G' and (resid 95 through 141 )G95 - 141
30X-RAY DIFFRACTION30chain 'G' and (resid 142 through 167 )G142 - 167
31X-RAY DIFFRACTION31chain 'H' and (resid 12 through 52 )H12 - 52
32X-RAY DIFFRACTION32chain 'H' and (resid 53 through 101 )H53 - 101
33X-RAY DIFFRACTION33chain 'H' and (resid 102 through 167 )H102 - 167
34X-RAY DIFFRACTION34chain 'I' and (resid 12 through 52 )I12 - 52
35X-RAY DIFFRACTION35chain 'I' and (resid 53 through 94 )I53 - 94
36X-RAY DIFFRACTION36chain 'I' and (resid 95 through 167 )I95 - 167
37X-RAY DIFFRACTION37chain 'J' and (resid 13 through 52 )J13 - 52
38X-RAY DIFFRACTION38chain 'J' and (resid 53 through 58 )J53 - 58
39X-RAY DIFFRACTION39chain 'J' and (resid 59 through 101 )J59 - 101
40X-RAY DIFFRACTION40chain 'J' and (resid 102 through 167 )J102 - 167
41X-RAY DIFFRACTION41chain 'K' and (resid 12 through 52 )K12 - 52
42X-RAY DIFFRACTION42chain 'K' and (resid 53 through 101 )K53 - 101
43X-RAY DIFFRACTION43chain 'K' and (resid 102 through 167 )K102 - 167
44X-RAY DIFFRACTION44chain 'L' and (resid 9 through 22 )L9 - 22
45X-RAY DIFFRACTION45chain 'L' and (resid 23 through 52 )L23 - 52
46X-RAY DIFFRACTION46chain 'L' and (resid 53 through 58 )L53 - 58
47X-RAY DIFFRACTION47chain 'L' and (resid 59 through 101 )L59 - 101
48X-RAY DIFFRACTION48chain 'L' and (resid 102 through 138 )L102 - 138
49X-RAY DIFFRACTION49chain 'L' and (resid 139 through 167 )L139 - 167
50X-RAY DIFFRACTION50chain 'M' and (resid 12 through 52 )M12 - 52
51X-RAY DIFFRACTION51chain 'M' and (resid 53 through 94 )M53 - 94
52X-RAY DIFFRACTION52chain 'M' and (resid 95 through 167 )M95 - 167
53X-RAY DIFFRACTION53chain 'N' and (resid 13 through 22 )N13 - 22
54X-RAY DIFFRACTION54chain 'N' and (resid 23 through 52 )N23 - 52
55X-RAY DIFFRACTION55chain 'N' and (resid 53 through 58 )N53 - 58
56X-RAY DIFFRACTION56chain 'N' and (resid 59 through 86 )N59 - 86
57X-RAY DIFFRACTION57chain 'N' and (resid 87 through 113 )N87 - 113
58X-RAY DIFFRACTION58chain 'N' and (resid 114 through 167 )N114 - 167
59X-RAY DIFFRACTION59chain 'O' and (resid 11 through 52 )O11 - 52
60X-RAY DIFFRACTION60chain 'O' and (resid 53 through 58 )O53 - 58
61X-RAY DIFFRACTION61chain 'O' and (resid 59 through 94 )O59 - 94
62X-RAY DIFFRACTION62chain 'O' and (resid 95 through 167 )O95 - 167
63X-RAY DIFFRACTION63chain 'P' and (resid 12 through 52 )P12 - 52
64X-RAY DIFFRACTION64chain 'P' and (resid 53 through 94 )P53 - 94
65X-RAY DIFFRACTION65chain 'P' and (resid 95 through 167 )P95 - 167
66X-RAY DIFFRACTION66chain 'Q' and (resid 9 through 22 )Q9 - 22
67X-RAY DIFFRACTION67chain 'Q' and (resid 23 through 52 )Q23 - 52
68X-RAY DIFFRACTION68chain 'Q' and (resid 53 through 58 )Q53 - 58
69X-RAY DIFFRACTION69chain 'Q' and (resid 59 through 86 )Q59 - 86
70X-RAY DIFFRACTION70chain 'Q' and (resid 87 through 138 )Q87 - 138
71X-RAY DIFFRACTION71chain 'Q' and (resid 139 through 167 )Q139 - 167
72X-RAY DIFFRACTION72chain 'R' and (resid 13 through 52 )R13 - 52
73X-RAY DIFFRACTION73chain 'R' and (resid 53 through 101 )R53 - 101
74X-RAY DIFFRACTION74chain 'R' and (resid 102 through 167 )R102 - 167
75X-RAY DIFFRACTION75chain 'S' and (resid 12 through 52 )S12 - 52
76X-RAY DIFFRACTION76chain 'S' and (resid 53 through 58 )S53 - 58
77X-RAY DIFFRACTION77chain 'S' and (resid 59 through 94 )S59 - 94
78X-RAY DIFFRACTION78chain 'S' and (resid 95 through 113 )S95 - 113
79X-RAY DIFFRACTION79chain 'S' and (resid 114 through 138 )S114 - 138
80X-RAY DIFFRACTION80chain 'S' and (resid 139 through 167 )S139 - 167
81X-RAY DIFFRACTION81chain 'T' and (resid 12 through 52 )T12 - 52
82X-RAY DIFFRACTION82chain 'T' and (resid 53 through 94 )T53 - 94
83X-RAY DIFFRACTION83chain 'T' and (resid 95 through 167 )T95 - 167
84X-RAY DIFFRACTION84chain 'U' and (resid 12 through 52 )U12 - 52
85X-RAY DIFFRACTION85chain 'U' and (resid 53 through 94 )U53 - 94
86X-RAY DIFFRACTION86chain 'U' and (resid 95 through 167 )U95 - 167
87X-RAY DIFFRACTION87chain 'V' and (resid 12 through 22 )V12 - 22
88X-RAY DIFFRACTION88chain 'V' and (resid 23 through 52 )V23 - 52
89X-RAY DIFFRACTION89chain 'V' and (resid 53 through 58 )V53 - 58
90X-RAY DIFFRACTION90chain 'V' and (resid 59 through 94 )V59 - 94
91X-RAY DIFFRACTION91chain 'V' and (resid 95 through 113 )V95 - 113
92X-RAY DIFFRACTION92chain 'V' and (resid 114 through 167 )V114 - 167
93X-RAY DIFFRACTION93chain 'W' and (resid 12 through 52 )W12 - 52
94X-RAY DIFFRACTION94chain 'W' and (resid 53 through 94 )W53 - 94
95X-RAY DIFFRACTION95chain 'W' and (resid 95 through 167 )W95 - 167
96X-RAY DIFFRACTION96chain 'X' and (resid 10 through 52 )X10 - 52
97X-RAY DIFFRACTION97chain 'X' and (resid 53 through 94 )X53 - 94
98X-RAY DIFFRACTION98chain 'X' and (resid 95 through 167 )X95 - 167

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