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- PDB-4ybb: High-resolution structure of the Escherichia coli ribosome -

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Basic information

Entry
Database: PDB / ID: 4ybb
TitleHigh-resolution structure of the Escherichia coli ribosome
Components
  • (23S rRNA23S ribosomal RNA) x 2
  • (30S ribosomal protein ...) x 20
  • (50S ribosomal protein ...) x 31
  • 16S rRNA
  • 5S rRNA5S ribosomal RNA
KeywordsRIBOSOME / Protein biosynthesis / ribosomes / RNA / transfer / exit / peptidyl / 30S / 70S / 16S / ribosomal subunit / posttranscriptional modification / posttranslational modification
Function / homology
Function and homology information


stringent response / mRNA base-pairing translational repressor activity / ornithine decarboxylase inhibitor activity / misfolded RNA binding / transcription antitermination factor activity, RNA binding / Group I intron splicing / RNA folding / transcriptional attenuation / endoribonuclease inhibitor activity / RNA-binding transcription regulator activity ...stringent response / mRNA base-pairing translational repressor activity / ornithine decarboxylase inhibitor activity / misfolded RNA binding / transcription antitermination factor activity, RNA binding / Group I intron splicing / RNA folding / transcriptional attenuation / endoribonuclease inhibitor activity / RNA-binding transcription regulator activity / positive regulation of ribosome biogenesis / negative regulation of cytoplasmic translation / translational termination / DnaA-L2 complex / four-way junction DNA binding / translation repressor activity / negative regulation of translational initiation / negative regulation of DNA-templated DNA replication initiation / regulation of mRNA stability / ribosome assembly / mRNA regulatory element binding translation repressor activity / response to reactive oxygen species / assembly of large subunit precursor of preribosome / transcription elongation factor complex / positive regulation of RNA splicing / DNA endonuclease activity / : / cytosolic ribosome assembly / regulation of DNA-templated transcription elongation / transcription antitermination / regulation of cell growth / maintenance of translational fidelity / DNA-templated transcription termination / response to radiation / mRNA 5'-UTR binding / ribosomal small subunit biogenesis / small ribosomal subunit rRNA binding / ribosomal small subunit assembly / ribosomal large subunit assembly / cytosolic small ribosomal subunit / large ribosomal subunit rRNA binding / ribosome binding / large ribosomal subunit / ribosome biogenesis / regulation of translation / small ribosomal subunit / 5S rRNA binding / cytosolic large ribosomal subunit / cytoplasmic translation / transferase activity / tRNA binding / negative regulation of translation / rRNA binding / molecular adaptor activity / ribosome / structural constituent of ribosome / translation / response to antibiotic / mRNA binding / negative regulation of DNA-templated transcription / DNA binding / RNA binding / zinc ion binding / membrane / cytosol / cytoplasm
Similarity search - Function
Ribosomal protein L10, eubacterial, conserved site / Ribosomal protein L10 signature. / Ribosomal protein L10 / : / Ribosomal protein S21, conserved site / Ribosomal protein S21 signature. / Ribosomal protein L25, short-form / Ribosomal protein S14, bacterial/plastid / Ribosomal protein L11, bacterial-type / Ribosomal protein S21 superfamily ...Ribosomal protein L10, eubacterial, conserved site / Ribosomal protein L10 signature. / Ribosomal protein L10 / : / Ribosomal protein S21, conserved site / Ribosomal protein S21 signature. / Ribosomal protein L25, short-form / Ribosomal protein S14, bacterial/plastid / Ribosomal protein L11, bacterial-type / Ribosomal protein S21 superfamily / Ribosomal protein S21 / Ribosomal protein S16, conserved site / Ribosomal protein S16 signature. / Ribosomal protein S21 / Ribosomal protein L11, conserved site / Ribosomal protein L10-like domain superfamily / Ribosomal protein L21, conserved site / Ribosomal protein L21 signature. / Ribosomal protein L10P / Ribosomal protein L10 / Ribosomal protein L11 signature. / Ribosomal protein L16 signature 1. / : / Ribosomal protein L6, conserved site / Ribosomal protein L6 signature 1. / Ribosomal protein L16, conserved site / Ribosomal protein L16 signature 2. / Ribosomal protein L11, N-terminal / Ribosomal protein L17 signature. / Ribosomal protein L9 signature. / Ribosomal protein L9, bacteria/chloroplast / Ribosomal protein L9, C-terminal / Ribosomal protein L9, C-terminal domain / Ribosomal protein L9, C-terminal domain superfamily / Ribosomal protein L11/L12 / Ribosomal protein L11, C-terminal / Ribosomal protein L11, C-terminal domain superfamily / Ribosomal protein L11/L12, N-terminal domain superfamily / Ribosomal protein L11/L12 / Ribosomal protein L11, N-terminal domain / Ribosomal protein L11, RNA binding domain / Ribosomal L25p family / Ribosomal protein L25 / Ribosomal protein L28/L24 superfamily / Ribosomal protein L36 signature. / Ribosomal protein L25/Gln-tRNA synthetase, N-terminal / Ribosomal protein L32p, bacterial type / Ribosomal protein L25/Gln-tRNA synthetase, anti-codon-binding domain superfamily / Ribosomal protein L9, N-terminal domain superfamily / Ribosomal protein L9 / Ribosomal protein L9, N-terminal / Ribosomal protein L9, N-terminal domain / Ribosomal protein L28 / Ribosomal protein L35, conserved site / Ribosomal protein L35 signature. / Ribosomal protein L33, conserved site / Ribosomal protein L33 signature. / Ribosomal protein L35, non-mitochondrial / Ribosomal protein L5, bacterial-type / Ribosomal protein L6, bacterial-type / Ribosomal protein L18, bacterial-type / Ribosomal protein L19, conserved site / Ribosomal protein L19 signature. / Ribosomal protein L36 / Ribosomal protein L36 superfamily / Ribosomal protein L36 / Ribosomal protein L9/RNase H1, N-terminal / Ribosomal protein L20 signature. / Ribosomal protein S3, bacterial-type / Ribosomal protein L27, conserved site / Ribosomal protein S6, conserved site / Ribosomal protein L27 signature. / Ribosomal protein S6 signature. / Ribosomal protein S19, bacterial-type / Ribosomal protein S7, bacterial/organellar-type / Ribosomal protein S11, bacterial-type / Ribosomal protein S13, bacterial-type / Ribosomal protein S20 / Ribosomal protein S20 superfamily / Ribosomal protein S20 / Ribosomal protein S9, bacterial/plastid / Ribosomal protein L14P, bacterial-type / Ribosomal protein S4, bacterial-type / Ribosomal protein L34, conserved site / Ribosomal protein L34 signature. / 30S ribosomal protein S17 / Ribosomal protein S5, bacterial-type / Ribosomal protein L22, bacterial/chloroplast-type / Ribosomal protein S6, plastid/chloroplast / Ribosomal protein L35 / Ribosomal protein L35 superfamily / Ribosomal protein L2, bacterial/organellar-type / Ribosomal protein L35 / Ribosomal protein S2, bacteria/mitochondria/plastid / Ribosomal L28 family / Ribosomal protein L33 / Ribosomal protein L33 / Ribosomal protein L28/L24 / Ribosomal protein L33 superfamily / :
Similarity search - Domain/homology
ACETIC ACID / GUANINE / DI(HYDROXYETHYL)ETHER / TRIETHYLENE GLYCOL / 1,4-DIAMINOBUTANE / SPERMIDINE / : / RNA / RNA (> 10) / RNA (> 100) ...ACETIC ACID / GUANINE / DI(HYDROXYETHYL)ETHER / TRIETHYLENE GLYCOL / 1,4-DIAMINOBUTANE / SPERMIDINE / : / RNA / RNA (> 10) / RNA (> 100) / RNA (> 1000) / Small ribosomal subunit protein bS6 / Small ribosomal subunit protein uS7 / Large ribosomal subunit protein uL15 / Large ribosomal subunit protein uL10 / Large ribosomal subunit protein uL11 / Large ribosomal subunit protein bL19 / Large ribosomal subunit protein bL20 / Large ribosomal subunit protein bL27 / Large ribosomal subunit protein bL28 / Large ribosomal subunit protein uL29 / Large ribosomal subunit protein bL32 / Large ribosomal subunit protein bL33 / Large ribosomal subunit protein bL34 / Large ribosomal subunit protein bL35 / Large ribosomal subunit protein bL36A / Large ribosomal subunit protein bL9 / Small ribosomal subunit protein uS10 / Small ribosomal subunit protein uS11 / Small ribosomal subunit protein uS12 / Small ribosomal subunit protein uS13 / Small ribosomal subunit protein bS16 / Small ribosomal subunit protein bS18 / Small ribosomal subunit protein uS19 / Small ribosomal subunit protein bS20 / Small ribosomal subunit protein uS2 / Small ribosomal subunit protein uS3 / Small ribosomal subunit protein uS4 / Small ribosomal subunit protein uS5 / Small ribosomal subunit protein uS8 / Small ribosomal subunit protein uS9 / Large ribosomal subunit protein uL13 / Large ribosomal subunit protein uL14 / Large ribosomal subunit protein uL16 / Large ribosomal subunit protein uL23 / Small ribosomal subunit protein uS15 / Large ribosomal subunit protein bL17 / Large ribosomal subunit protein bL21 / Large ribosomal subunit protein uL30 / Large ribosomal subunit protein uL6 / Small ribosomal subunit protein uS14 / Small ribosomal subunit protein uS17 / Large ribosomal subunit protein uL18 / Large ribosomal subunit protein uL2 / Large ribosomal subunit protein uL3 / Large ribosomal subunit protein uL24 / Large ribosomal subunit protein uL4 / Large ribosomal subunit protein uL22 / Large ribosomal subunit protein uL5 / Small ribosomal subunit protein bS21 / Large ribosomal subunit protein bL25
Similarity search - Component
Biological speciesEscherichia coli K-12 (bacteria)
Escherichia coli (E. coli)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.1 Å
AuthorsNoeske, J. / Wasserman, M.R. / Terry, D.S. / Altman, R.B. / Blanchard, S.C. / Cate, J.H.D.
CitationJournal: Nat.Struct.Mol.Biol. / Year: 2015
Title: High-resolution structure of the Escherichia coli ribosome.
Authors: Noeske, J. / Wasserman, M.R. / Terry, D.S. / Altman, R.B. / Blanchard, S.C. / Cate, J.H.
History
DepositionFeb 18, 2015Deposition site: RCSB / Processing site: RCSB
Revision 1.0Mar 18, 2015Provider: repository / Type: Initial release
Revision 1.1Apr 15, 2015Group: Database references
Revision 2.0Sep 27, 2023Group: Advisory / Data collection ...Advisory / Data collection / Database references / Derived calculations / Polymer sequence / Refinement description / Source and taxonomy
Category: chem_comp / chem_comp_atom ...chem_comp / chem_comp_atom / chem_comp_bond / database_2 / entity_poly / entity_src_nat / pdbx_initial_refinement_model / pdbx_struct_conn_angle / pdbx_struct_oper_list / pdbx_validate_close_contact / struct_conn / struct_conn_type / struct_ncs_dom_lim
Item: _chem_comp.mon_nstd_flag / _database_2.pdbx_DOI ..._chem_comp.mon_nstd_flag / _database_2.pdbx_DOI / _database_2.pdbx_database_accession / _entity_poly.pdbx_seq_one_letter_code_can / _entity_src_nat.pdbx_alt_source_flag / _pdbx_struct_conn_angle.ptnr1_auth_asym_id / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_alt_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_asym_id / _pdbx_struct_conn_angle.ptnr2_auth_comp_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr2_label_atom_id / _pdbx_struct_conn_angle.ptnr2_label_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_alt_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _pdbx_struct_oper_list.symmetry_operation / _struct_conn.conn_type_id / _struct_conn.id / _struct_conn.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _struct_conn.pdbx_ptnr1_label_alt_id / _struct_conn.pdbx_ptnr2_label_alt_id / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id / _struct_conn_type.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
Revision 2.1Nov 15, 2023Group: Data collection / Database references / Derived calculations
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / struct_conn / struct_ref
Item: _chem_comp_atom.atom_id / _chem_comp_bond.atom_id_1 ..._chem_comp_atom.atom_id / _chem_comp_bond.atom_id_1 / _chem_comp_bond.atom_id_2 / _struct_conn.pdbx_leaving_atom_flag / _struct_ref.pdbx_seq_one_letter_code

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
AA: 16S rRNA
AB: 30S ribosomal protein S2
AC: 30S ribosomal protein S3
AD: 30S ribosomal protein S4
AE: 30S ribosomal protein S5
AF: 30S ribosomal protein S6
AG: 30S ribosomal protein S7
AH: 30S ribosomal protein S8
AI: 30S ribosomal protein S9
AJ: 30S ribosomal protein S10
AK: 30S ribosomal protein S11
AL: 30S ribosomal protein S12
AM: 30S ribosomal protein S13
AN: 30S ribosomal protein S14
AO: 30S ribosomal protein S15
AP: 30S ribosomal protein S16
AQ: 30S ribosomal protein S17
AR: 30S ribosomal protein S18
AS: 30S ribosomal protein S19
AT: 30S ribosomal protein S20
AU: 30S ribosomal protein S21
BA: 16S rRNA
BB: 30S ribosomal protein S2
BC: 30S ribosomal protein S3
BD: 30S ribosomal protein S4
BE: 30S ribosomal protein S5
BF: 30S ribosomal protein S6
BG: 30S ribosomal protein S7
BH: 30S ribosomal protein S8
BI: 30S ribosomal protein S9
BJ: 30S ribosomal protein S10
BK: 30S ribosomal protein S11
BL: 30S ribosomal protein S12
BM: 30S ribosomal protein S13
BN: 30S ribosomal protein S14
BO: 30S ribosomal protein S15
BP: 30S ribosomal protein S16
BQ: 30S ribosomal protein S17
BR: 30S ribosomal protein S18
BS: 30S ribosomal protein S19
BT: 30S ribosomal protein S20
BU: 30S ribosomal protein S21
CA: 23S rRNA
CB: 5S rRNA
CC: 50S ribosomal protein L2
CD: 50S ribosomal protein L3
CE: 50S ribosomal protein L4
CF: 50S ribosomal protein L5
CG: 50S ribosomal protein L6
CH: 50S ribosomal protein L9
CJ: 50S ribosomal protein L11
CK: 50S ribosomal protein L13
CL: 50S ribosomal protein L14
CM: 50S ribosomal protein L15
CN: 50S ribosomal protein L16
CO: 50S ribosomal protein L17
CP: 50S ribosomal protein L18
CQ: 50S ribosomal protein L19
CR: 50S ribosomal protein L20
CS: 50S ribosomal protein L21
CT: 50S ribosomal protein L22
CU: 50S ribosomal protein L23
CV: 50S ribosomal protein L24
CW: 50S ribosomal protein L25
CX: 50S ribosomal protein L27
CY: 50S ribosomal protein L28
CZ: 50S ribosomal protein L29
C0: 50S ribosomal protein L30
C1: 50S ribosomal protein L32
C2: 50S ribosomal protein L33
C3: 50S ribosomal protein L34
C4: 50S ribosomal protein L35
C5: 50S ribosomal protein L36
DA: 23S rRNA
DB: 5S rRNA
DC: 50S ribosomal protein L2
DD: 50S ribosomal protein L3
DE: 50S ribosomal protein L4
DF: 50S ribosomal protein L5
DG: 50S ribosomal protein L6
DH: 50S ribosomal protein L9
DI: 50S ribosomal protein L10
DJ: 50S ribosomal protein L11
DK: 50S ribosomal protein L13
DL: 50S ribosomal protein L14
DM: 50S ribosomal protein L15
DN: 50S ribosomal protein L16
DO: 50S ribosomal protein L17
DP: 50S ribosomal protein L18
DQ: 50S ribosomal protein L19
DR: 50S ribosomal protein L20
DS: 50S ribosomal protein L21
DT: 50S ribosomal protein L22
DU: 50S ribosomal protein L23
DV: 50S ribosomal protein L24
DW: 50S ribosomal protein L25
DX: 50S ribosomal protein L27
DY: 50S ribosomal protein L28
DZ: 50S ribosomal protein L29
D0: 50S ribosomal protein L30
D1: 50S ribosomal protein L32
D2: 50S ribosomal protein L33
D3: 50S ribosomal protein L34
D4: 50S ribosomal protein L35
D5: 50S ribosomal protein L36
hetero molecules


Theoretical massNumber of molelcules
Total (without water)4,270,475651
Polymers4,249,827105
Non-polymers20,649546
Water139,6167750
1
AA: 16S rRNA
AB: 30S ribosomal protein S2
AC: 30S ribosomal protein S3
AD: 30S ribosomal protein S4
AE: 30S ribosomal protein S5
AF: 30S ribosomal protein S6
AG: 30S ribosomal protein S7
AH: 30S ribosomal protein S8
AI: 30S ribosomal protein S9
AJ: 30S ribosomal protein S10
AK: 30S ribosomal protein S11
AL: 30S ribosomal protein S12
AM: 30S ribosomal protein S13
AN: 30S ribosomal protein S14
AO: 30S ribosomal protein S15
AP: 30S ribosomal protein S16
AQ: 30S ribosomal protein S17
AR: 30S ribosomal protein S18
AS: 30S ribosomal protein S19
AT: 30S ribosomal protein S20
AU: 30S ribosomal protein S21
DA: 23S rRNA
DB: 5S rRNA
DC: 50S ribosomal protein L2
DD: 50S ribosomal protein L3
DE: 50S ribosomal protein L4
DF: 50S ribosomal protein L5
DG: 50S ribosomal protein L6
DH: 50S ribosomal protein L9
DI: 50S ribosomal protein L10
DJ: 50S ribosomal protein L11
DK: 50S ribosomal protein L13
DL: 50S ribosomal protein L14
DM: 50S ribosomal protein L15
DN: 50S ribosomal protein L16
DO: 50S ribosomal protein L17
DP: 50S ribosomal protein L18
DQ: 50S ribosomal protein L19
DR: 50S ribosomal protein L20
DS: 50S ribosomal protein L21
DT: 50S ribosomal protein L22
DU: 50S ribosomal protein L23
DV: 50S ribosomal protein L24
DW: 50S ribosomal protein L25
DX: 50S ribosomal protein L27
DY: 50S ribosomal protein L28
DZ: 50S ribosomal protein L29
D0: 50S ribosomal protein L30
D1: 50S ribosomal protein L32
D2: 50S ribosomal protein L33
D3: 50S ribosomal protein L34
D4: 50S ribosomal protein L35
D5: 50S ribosomal protein L36
hetero molecules


Theoretical massNumber of molelcules
Total (without water)2,147,580397
Polymers2,132,05353
Non-polymers15,528344
Water84747
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
BA: 16S rRNA
BB: 30S ribosomal protein S2
BC: 30S ribosomal protein S3
BD: 30S ribosomal protein S4
BE: 30S ribosomal protein S5
BF: 30S ribosomal protein S6
BG: 30S ribosomal protein S7
BH: 30S ribosomal protein S8
BI: 30S ribosomal protein S9
BJ: 30S ribosomal protein S10
BK: 30S ribosomal protein S11
BL: 30S ribosomal protein S12
BM: 30S ribosomal protein S13
BN: 30S ribosomal protein S14
BO: 30S ribosomal protein S15
BP: 30S ribosomal protein S16
BQ: 30S ribosomal protein S17
BR: 30S ribosomal protein S18
BS: 30S ribosomal protein S19
BT: 30S ribosomal protein S20
BU: 30S ribosomal protein S21
CA: 23S rRNA
CB: 5S rRNA
CC: 50S ribosomal protein L2
CD: 50S ribosomal protein L3
CE: 50S ribosomal protein L4
CF: 50S ribosomal protein L5
CG: 50S ribosomal protein L6
CH: 50S ribosomal protein L9
CJ: 50S ribosomal protein L11
CK: 50S ribosomal protein L13
CL: 50S ribosomal protein L14
CM: 50S ribosomal protein L15
CN: 50S ribosomal protein L16
CO: 50S ribosomal protein L17
CP: 50S ribosomal protein L18
CQ: 50S ribosomal protein L19
CR: 50S ribosomal protein L20
CS: 50S ribosomal protein L21
CT: 50S ribosomal protein L22
CU: 50S ribosomal protein L23
CV: 50S ribosomal protein L24
CW: 50S ribosomal protein L25
CX: 50S ribosomal protein L27
CY: 50S ribosomal protein L28
CZ: 50S ribosomal protein L29
C0: 50S ribosomal protein L30
C1: 50S ribosomal protein L32
C2: 50S ribosomal protein L33
C3: 50S ribosomal protein L34
C4: 50S ribosomal protein L35
C5: 50S ribosomal protein L36
hetero molecules


Theoretical massNumber of molelcules
Total (without water)2,122,895254
Polymers2,117,77452
Non-polymers5,121202
Water46826
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)212.170, 433.890, 624.250
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
11chain AC and resid 2004:2227 and not (resid 2165 or resid 2188 or resid 2204:2205)
21chain AF and resid 2004:2227 and not (resid 2165 or resid 2188 or resid 2204:2205)

NCS domain segments:

Component-ID: 1 / Ens-ID: 1

Dom-IDBeg auth comp-IDBeg label comp-IDEnd auth comp-IDEnd label comp-IDSelection detailsAuth asym-IDLabel asym-IDAuth seq-IDLabel seq-ID
1GLYGLYILEILEchain AC and resid 2004:2227 and not (resid 2165 or resid 2188 or resid 2204:2205)ACC2 - 2071 - 206
2METMETLYSLYSchain AF and resid 2004:2227 and not (resid 2165 or resid 2188 or resid 2204:2205)AFF1 - 1061 - 106

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Components

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RNA chain , 4 types, 6 molecules AABACACBDBDA

#1: RNA chain 16S rRNA /


Mass: 497404.969 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli K-12 (bacteria) / References: GenBank: 731469900
#22: RNA chain 23S rRNA / 23S ribosomal RNA


Mass: 941809.562 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Escherichia coli K-12 (bacteria) / References: GenBank: 731469900
#23: RNA chain 5S rRNA / 5S ribosomal RNA


Mass: 38790.090 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli K-12 (bacteria) / References: GenBank: 731469900
#53: RNA chain 23S rRNA / 23S ribosomal RNA


Mass: 941505.375 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Escherichia coli K-12 (bacteria) / References: GenBank: 731469900

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30S ribosomal protein ... , 20 types, 40 molecules ABBBACBCADBDAEBEAFBFAGBGAHBHAIBIAJBJAKBKALBLAMBMANBNAOBOAPBP...

#2: Protein 30S ribosomal protein S2 /


Mass: 24971.764 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7V0
#3: Protein 30S ribosomal protein S3 /


Mass: 23078.785 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7V3
#4: Protein 30S ribosomal protein S4 /


Mass: 23383.002 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7V8
#5: Protein 30S ribosomal protein S5 /


Mass: 16361.878 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7W1
#6: Protein 30S ribosomal protein S6 /


Mass: 12326.251 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P02358
#7: Protein 30S ribosomal protein S7 /


Mass: 16861.523 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P02359
#8: Protein 30S ribosomal protein S8 /


Mass: 14015.361 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7W7
#9: Protein 30S ribosomal protein S9 /


Mass: 14554.882 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7X3
#10: Protein 30S ribosomal protein S10 /


Mass: 11325.117 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7R5
#11: Protein 30S ribosomal protein S11 /


Mass: 12487.200 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7R9
#12: Protein 30S ribosomal protein S12 /


Mass: 13683.053 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7S3
#13: Protein 30S ribosomal protein S13 /


Mass: 12625.753 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7S9
#14: Protein 30S ribosomal protein S14 /


Mass: 11475.364 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG59
#15: Protein 30S ribosomal protein S15 /


Mass: 10159.621 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0ADZ4
#16: Protein 30S ribosomal protein S16 /


Mass: 9207.572 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7T3
#17: Protein 30S ribosomal protein S17 /


Mass: 9263.946 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG63
#18: Protein 30S ribosomal protein S18 /


Mass: 6466.477 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7T7
#19: Protein 30S ribosomal protein S19 /


Mass: 9057.626 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7U3
#20: Protein 30S ribosomal protein S20 /


Mass: 9577.268 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7U7
#21: Protein 30S ribosomal protein S21 /


Mass: 6629.744 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P68679

+
50S ribosomal protein ... , 31 types, 59 molecules CCDCCDCEDECFDFCGDGCHDHCJDJCKDKCLDLCMDMCNDNCODOCPDPCQDQCRDRCS...

#24: Protein 50S ribosomal protein L2 /


Mass: 29663.244 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P60422
#25: Protein 50S ribosomal protein L3 /


Mass: 22277.535 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P60438
#26: Protein 50S ribosomal protein L4 /


Mass: 22121.566 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P60723
#27: Protein 50S ribosomal protein L5 /


Mass: 20073.234 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P62399
#28: Protein 50S ribosomal protein L6 /


Mass: 18801.598 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG55
#29: Protein 50S ribosomal protein L9 /


Mass: 15789.020 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7R1
#30: Protein 50S ribosomal protein L11 /


Mass: 14020.303 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7J7
#31: Protein 50S ribosomal protein L13 /


Mass: 16050.606 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AA10
#32: Protein 50S ribosomal protein L14 /


Mass: 13565.067 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0ADY3
#33: Protein 50S ribosomal protein L15 /


Mass: 15008.471 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P02413
#34: Protein 50S ribosomal protein L16 /


Mass: 15327.261 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0ADY7
#35: Protein 50S ribosomal protein L17 /


Mass: 14193.465 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG44
#36: Protein 50S ribosomal protein L18 /


Mass: 12794.668 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0C018
#37: Protein 50S ribosomal protein L19 /


Mass: 13028.082 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7K6
#38: Protein 50S ribosomal protein L20 /


Mass: 13396.828 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7L3
#39: Protein 50S ribosomal protein L21 /


Mass: 11586.374 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG48
#40: Protein 50S ribosomal protein L22 /


Mass: 12253.359 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P61175
#41: Protein 50S ribosomal protein L23 /


Mass: 10546.472 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0ADZ0
#42: Protein 50S ribosomal protein L24 /


Mass: 11078.874 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P60624
#43: Protein 50S ribosomal protein L25 /


Mass: 10713.465 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P68919
#44: Protein 50S ribosomal protein L27 /


Mass: 8275.498 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7L8
#45: Protein 50S ribosomal protein L28 /


Mass: 8896.354 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7M2
#46: Protein 50S ribosomal protein L29 /


Mass: 7155.267 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7M6
#47: Protein 50S ribosomal protein L30 /


Mass: 6423.625 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0AG51
#48: Protein 50S ribosomal protein L32 /


Mass: 6332.249 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7N4
#49: Protein 50S ribosomal protein L33 /


Mass: 5928.000 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (E. coli) / Strain: K12 / References: UniProt: P0A7N9
#50: Protein/peptide 50S ribosomal protein L34 /


Mass: 5397.463 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7P5
#51: Protein 50S ribosomal protein L35 / / Ribosomal protein A


Mass: 7181.835 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7Q1
#52: Protein/peptide 50S ribosomal protein L36 / / Ribosomal protein B


Mass: 4377.390 Da / Num. of mol.: 2 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7Q6
#54: Protein 50S ribosomal protein L3 /


Mass: 22291.562 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P60438
#55: Protein 50S ribosomal protein L10 / / 50S ribosomal protein L8


Mass: 14568.748 Da / Num. of mol.: 1 / Source method: isolated from a natural source / Source: (natural) Escherichia coli (strain K12) (bacteria) / Strain: K12 / References: UniProt: P0A7J3

-
Non-polymers , 14 types, 8296 molecules

#56: Chemical...
ChemComp-MG / MAGNESIUM ION


Mass: 24.305 Da / Num. of mol.: 463 / Source method: obtained synthetically / Formula: Mg
#57: Chemical
ChemComp-PG4 / TETRAETHYLENE GLYCOL / Polyethylene glycol


Mass: 194.226 Da / Num. of mol.: 7 / Source method: obtained synthetically / Formula: C8H18O5 / Comment: precipitant*YM
#58: Chemical
ChemComp-MPD / (4S)-2-METHYL-2,4-PENTANEDIOL / 2-Methyl-2,4-pentanediol


Mass: 118.174 Da / Num. of mol.: 14 / Source method: obtained synthetically / Formula: C6H14O2 / Comment: precipitant*YM
#59: Chemical
ChemComp-PUT / 1,4-DIAMINOBUTANE / PUTRESCINE / Putrescine


Mass: 88.151 Da / Num. of mol.: 16 / Source method: obtained synthetically / Formula: C4H12N2
#60: Chemical ChemComp-ZN / ZINC ION


Mass: 65.409 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Zn
#61: Chemical
ChemComp-PEG / DI(HYDROXYETHYL)ETHER / Diethylene glycol


Mass: 106.120 Da / Num. of mol.: 11 / Source method: obtained synthetically / Formula: C4H10O3
#62: Chemical
ChemComp-SPD / SPERMIDINE / N-(2-AMINO-PROPYL)-1,4-DIAMINOBUTANE / PA(34) / Spermidine


Mass: 145.246 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C7H19N3
#63: Chemical ChemComp-1PE / PENTAETHYLENE GLYCOL / PEG400 / Polyethylene glycol


Mass: 238.278 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C10H22O6 / Comment: precipitant*YM
#64: Chemical
ChemComp-PGE / TRIETHYLENE GLYCOL / Polyethylene glycol


Mass: 150.173 Da / Num. of mol.: 9 / Source method: obtained synthetically / Formula: C6H14O4
#65: Chemical ChemComp-ACY / ACETIC ACID / Acetic acid


Mass: 60.052 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: C2H4O2
#66: Chemical
ChemComp-EDO / 1,2-ETHANEDIOL / ETHYLENE GLYCOL / Ethylene glycol


Mass: 62.068 Da / Num. of mol.: 12 / Source method: obtained synthetically / Formula: C2H6O2
#67: Chemical ChemComp-GUN / GUANINE / Guanine


Mass: 151.126 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C5H5N5O
#68: Chemical ChemComp-TRS / 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / TRIS BUFFER / Tris


Mass: 122.143 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C4H12NO3 / Comment: pH buffer*YM
#69: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 7750 / Source method: isolated from a natural source / Formula: H2O

-
Experimental details

-
Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 32

-
Sample preparation

CrystalDensity Matthews: 3.39 Å3/Da / Density % sol: 63.68 %
Crystal growTemperature: 291 K / Method: microbatch / pH: 6.5 / Details: PEG8k, MPD

-
Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: ALS / Beamline: 8.3.1 / Wavelength: 1.1 Å
DetectorType: ADSC QUANTUM 315 / Detector: CCD / Date: Feb 1, 2013
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.1 Å / Relative weight: 1
ReflectionResolution: 2→69.388 Å / Num. obs: 3309372 / % possible obs: 86.9 % / Observed criterion σ(I): -3 / Redundancy: 3.97 % / Biso Wilson estimate: 52.53 Å2 / Rmerge F obs: 0.996 / Rmerge(I) obs: 0.154 / Rrim(I) all: 0.169 / Χ2: 1.019 / Net I/σ(I): 4.77 / Num. measured all: 13135436
Reflection shell

Diffraction-ID: 1 / Rejects: 0

Resolution (Å)Highest resolution (Å)Rmerge F obsRmerge(I) obsMean I/σ(I) obsNum. measured obsNum. possibleNum. unique obsRrim(I) all% possible all
2-2.050.0253.3860.162042662809131079024.10538.4
2.05-2.110.0722.3570.213306512737821670232.84261
2.11-2.170.1371.6880.284493522663102153202.05280.9
2.17-2.240.2081.3220.374955912586392206111.60485.3
2.24-2.310.3121.0410.495236352507872200401.25687.7
2.31-2.390.4310.8420.655698622426032186471.01190.1
2.39-2.480.5550.6640.885911852340862137060.79291.3
2.48-2.580.6980.5021.226096802255052089340.59492.7
2.58-2.70.80.3851.766331172162182038530.45394.3
2.7-2.830.8690.32.526360442068651957740.35194.6
2.83-2.980.9110.263.776793751967591891430.396.1
2.98-3.160.8890.3435.768575371862821841950.38698.9
3.16-3.380.9270.3327.779811611751721739640.36599.3
3.38-3.650.9580.2549.379965451631841621900.27899.4
3.65-40.9750.1911.249869731503221493310.20699.3
4-4.470.9830.15813.059671691361261353440.1799.4
4.47-5.160.9890.12915.229246811203721197350.13899.5
5.16-6.320.9930.10616.877954181019301013720.11399.5
6.32-8.940.9950.08318.660890279323788360.08999.4
8.940.9990.04622.0129429244449434520.0597.8

-
Processing

Software
NameVersionClassification
PHENIXrefinement
XSCALEdata scaling
PDB_EXTRACT3.15data extraction
XDSdata reduction
PHENIXphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 4V9D
Resolution: 2.1→69.388 Å / SU ML: 0.36 / Cross valid method: FREE R-VALUE / σ(F): 1.33 / Phase error: 33.45 / Stereochemistry target values: ML
RfactorNum. reflection% reflection
Rfree0.2338 10048 0.33 %
Rwork0.2185 3053878 -
obs0.2186 3063926 93.05 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Displacement parametersBiso max: 177.73 Å2 / Biso mean: 88.4994 Å2 / Biso min: 42.42 Å2
Refinement stepCycle: final / Resolution: 2.1→69.388 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms18770 32930 131 549 52380
Biso mean--70.82 63.63 -
Num. residues----3916
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.008313573
X-RAY DIFFRACTIONf_angle_d1.27469224
X-RAY DIFFRACTIONf_chiral_restr0.05259448
X-RAY DIFFRACTIONf_plane_restr0.00725195
X-RAY DIFFRACTIONf_dihedral_angle_d15.521145369
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDRmsType
11AC2627X-RAY DIFFRACTION3.562TORSIONAL
12AF2627X-RAY DIFFRACTION3.562TORSIONAL
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 30

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.1-2.12390.42481590.4089857668592579
2.1239-2.14890.3921810.3883880728825381
2.1489-2.17510.37511890.3727902909047983
2.1751-2.20260.35632000.353919899218984
2.2026-2.23160.35092230.3445943619458486
2.2316-2.26220.34332280.3269946989492687
2.2622-2.29450.34412360.3151958539608988
2.2945-2.32870.33962640.3249974759773989
2.3287-2.36510.32612810.3177983309861190
2.3651-2.40390.2832870.3112987219900891
2.4039-2.44530.3143030.3039995549985791
2.4453-2.48980.31343120.292710004810036092
2.4898-2.53770.33123210.275510051810083992
2.5377-2.58950.28323360.273910211810245494
2.5895-2.64580.29383460.272710278910313594
2.6458-2.70740.27863460.26410302310336994
2.7074-2.77510.28633480.27210318710353594
2.7751-2.85010.27673560.266310379810415495
2.8501-2.9340.26113730.253510482410519796
2.934-3.02870.26453900.241410664710703798
3.0287-3.13690.26224290.229510833710876699
3.1369-3.26250.23594340.210810858710902199
3.2625-3.4110.24274360.205810863610907299
3.411-3.59080.22584360.199210884410928099
3.5908-3.81580.23154360.190310887110930799
3.8158-4.11040.20124360.187510897910941599
4.1104-4.52390.21674380.186510928110971999
4.5239-5.17840.19884390.180710954710998699
5.1784-6.52340.18844410.181710987011031199
6.5234-69.42620.21194440.190511086511130999
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)
10.8875-0.1967-0.19340.76930.01530.51710.11760.40010.1867-0.5101-0.1504-0.2254-0.1709-0.00280.02280.79960.07280.1350.51980.2640.5651-61.687612.9358-75.0567
20.10510.1207-0.00890.1531-0.05750.27690.02640.04920.0621-0.0353-0.0322-0.0067-0.11010.04910.00230.63430.0977-0.00110.4150.17010.7137-86.30636.2636-31.1071
31.79160.8986-1.14220.9599-0.73371.21870.10250.32230.433-0.04730.15380.3649-0.3214-0.274-0.25730.80060.1798-0.02840.64880.20030.9199-98.813656.8689-40.0979
40.6620.4525-0.04320.41620.07090.1017-0.04620.19030.2247-0.09640.0089-0.02-0.23440.09670.03450.99060.08350.02030.68140.31410.9629-78.460557.2218-47.4594
50.5168-0.0460.19850.09730.00950.4007-0.04960.04560.3167-0.02590.05580.0739-0.232-0.0051-0.00581.30350.0717-0.06760.66290.16741.4131-85.823985.8409-19.1954
60.3813-0.3227-0.18630.70840.30790.49780.07870.06980.20270.012-0.07740.2327-0.2866-0.3203-0.01111.23290.12630.01621.06950.10421.3135-115.501583.1626-19.6386
70.72320.1362-0.07480.1309-0.1110.53420.087-0.08710.19510.06660.10310.2234-0.1627-0.2923-0.18450.80450.19590.14620.62540.27121.0546-146.069343.0555-3.0331
80.6773-0.18640.19240.1680.12950.33930.01380.15340.0523-0.1772-0.03370.1345-0.1513-0.22960.02211.5026-0.0851-0.03771.41370.10441.6791-168.561521.3022-46.4537
90.4022-0.04830.04370.5145-0.19570.67790.0096-0.07720.32220.18530.0068-0.1514-0.41490.0884-0.01790.65640.0239-0.04530.30270.00880.7476-64.859738.6747-2.7233
100.31870.0457-0.09750.4953-0.05070.3988-0.06720.16740.0516-0.0869-0.056-0.24050.05590.0790.10150.49960.00390.04210.39470.18730.5806-56.2295-6.7-41.9101
110.3377-0.0103-0.07060.2504-0.00990.1789-0.0092-0.0740.07020.08270.0071-0.0467-0.03250.0440.00290.21130.0106-0.03510.1620.00410.1787-65.9601-59.919614.8416
120.9265-0.2958-0.00031.1615-0.04761.0317-0.00650.38771.0048-0.58450.01420.0788-0.8199-0.3558-0.01751.07610.0408-0.14661.22640.37881.5813-143.6183-55.8883-66.113
130.9255-0.06450.83020.29580.09511.5547-0.0459-0.0455-0.0968-0.18850.14490.17940.1647-0.3678-0.0970.6175-0.07470.03840.66220.05460.704-103.4159-3.9216-3.3395
140.54480.1407-0.17760.4526-0.26820.60060.1462-0.33510.24090.44270.11390.432-0.2784-0.639-0.21471.4006-0.02280.27831.41-0.10111.5549-100.745721.229990.7375
150.13980.1644-0.00592.0271-0.73950.2952-0.02520.11960.24290.1057-0.0234-0.008-0.2467-0.03450.04321.5527-0.05040.09871.2442-0.02921.4667-149.2194-26.8805-11.7974
160.6963-0.36480.21961.34440.24551.1391-0.09320.30730.3919-0.07990.0188-0.1089-0.37220.33450.05570.4121-0.0625-0.0020.62510.18730.8238-166.4055-23.682516.3769
170.5318-0.38220.10220.66720.17090.4999-0.00070.0349-0.08510.0912-0.07350.37550.0497-0.18730.06040.3440.01770.13860.48340.05020.7119-174.6341-53.904130.4645
180.2443-0.1980.27840.6570.42781.2376-0.0141-0.0270.06950.03150.00930.1692-0.0182-0.1321-0.00090.212-0.01230.040.24140.01990.3628-138.5004-72.871711.7228
190.27310.49250.20630.88410.37160.15770.0493-0.034-0.02910.055-0.08810.1370.1391-0.17660.03691.5819-0.199-0.01951.4884-0.05731.3876-61.154517.0377119.077
200.8339-0.01120.26720.17530.17950.7205-0.0272-0.2041-0.35190.23990.0661-0.13860.22930.2053-0.02131.151-0.0087-0.16180.50040.10320.8328-28.046235.7763104.1689
210.24690.111-0.0930.43080.02840.1525-0.0488-0.0761-0.06360.054-0.0011-0.1711-0.01940.01070.04631.1047-0.2601-0.26730.5060.07450.5027-41.391581.87576.173
221.3089-1.0248-0.48161.17850.45730.53170.05660.1931-0.1663-0.1893-0.16670.1390.0742-0.11270.10311.2576-0.2607-0.2990.7966-0.03450.7547-51.415973.836253.8362
230.35-0.112-0.140.16190.06990.292-0.01170.1307-0.2015-0.0754-0.0225-0.02120.13820.01780.03091.219-0.1612-0.19450.8307-0.04931.0212-32.771163.419257.5334
240.32760.07550.05380.1071-0.02110.1209-0.00980.239-0.0516-0.1795-0.0289-0.01210.0739-0.02950.03181.6773-0.1537-0.04421.3857-0.10391.035-30.098190.43827.1248
251.5267-0.92460.66230.5629-0.38520.80650.34390.0799-0.1242-0.2244-0.1620.32230.1734-0.1657-0.17991.3577-0.0626-0.10961.236-0.0361.2183-59.572294.516524.2918
261.3142-0.07250.07890.41430.07290.6262-0.1105-0.00770.61460.03130.04690.5241-0.2719-0.42980.05341.201-0.0661-0.19191.0010.13961.3874-95.0461115.353156.7805
270.26220.0013-0.10950.1399-0.02830.16420.057-0.0372-0.04460.0271-0.07570.12620.0595-0.11950.01592.1243-0.15780.0312.25910.03242.0429-125.091372.881173.5058
280.79440.15950.02030.89430.16520.3610.12760.00280.0340.087-0.1336-0.3661-0.16890.10650.0131.0225-0.2298-0.18860.55730.10740.5121-15.2401106.470776.9645
290.15050.0919-0.12360.32230.18560.2938-0.247-0.1432-0.11980.16460.2354-0.02650.00890.09530.01151.147-0.0676-0.14780.81620.10780.6992-23.143869.1836124.6559
300.3432-0.0521-0.22940.2998-0.03460.56850.041-0.32510.12820.20410.0787-0.0466-0.25530.3744-0.09711.1886-0.2671-0.11411.0157-0.12590.5338-30.4517130.627172.2518
310.3698-0.0052-0.09830.3294-0.07580.26930.18570.11820.0603-0.2032-0.0228-0.0380.1440.0859-0.13192.0003-0.0233-0.01392.2699-0.07012.1604-116.908271.6057151.8157
321.07940.4887-0.17570.9707-0.32290.33340.046-0.0585-0.20960.1273-0.10630.28990.258-0.25110.05671.2202-0.29270.09491.1195-0.07261.05-60.5957115.4319111.0396
330.38010.0271-0.07910.07010.08410.34090.0024-0.09460.31230.16870.02140.3221-0.3562-0.4708-0.02541.65150.08840.19711.7401-0.01741.6142-32.939202.913988.6869
340.0049-0.0075-0.02480.03160.09910.33870.02430.0636-0.0158-0.07480.0427-0.0115-0.0320.0237-0.05621.82170.01020.02581.88840.03161.8084-110.6795119.8022125.321
350.01680.02350.02160.0395-0.0020.12670.02560.1525-0.0774-0.11730.018-0.00310.0375-0.0366-0.03452.03480.0389-0.02982.1007-0.07071.9846-121.3153152.2408117.7066
360.1012-0.05270.07190.3434-0.1340.1122-0.02340.13220.1413-0.06830.11330.2831-0.1526-0.2465-0.07891.6970.32450.03921.76320.24951.8726-129.5549170.6541145.0175
370.25770.1558-0.16590.1508-0.020.23930.03150.07250.1005-0.04050.03890.1195-0.1696-0.1922-0.05921.32690.1480.10521.31020.18271.2342-103.1822145.3846171.3391
380.52730.0129-0.46050.0318-0.00740.7101-0.0496-0.1286-0.00290.1005-0.01750.0880.1111-0.18720.06281.356-0.10180.25531.02470.04861.353414.9951224.863795.0493
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1(chain A and (resid 2:8 or resid 27:557)) or (chain C and (resid 2602:2806 or resid 5901:5982 or resid 6303:6387 or resid 5223:5324 or resid 6004:6083))AA - A2 - 8
2X-RAY DIFFRACTION1(chain A and (resid 2:8 or resid 27:557)) or (chain C and (resid 2602:2806 or resid 5901:5982 or resid 6303:6387 or resid 5223:5324 or resid 6004:6083))AA - A27 - 557
3X-RAY DIFFRACTION2(chain A and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain C and resid 5202:5222)AA - A9 - 26
4X-RAY DIFFRACTION2(chain A and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain C and resid 5202:5222)AA - A558 - 562
5X-RAY DIFFRACTION2(chain A and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain C and resid 5202:5222)AA - A564 - 566
6X-RAY DIFFRACTION2(chain A and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain C and resid 5202:5222)AA - A914 - 925
7X-RAY DIFFRACTION2(chain A and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain C and resid 5202:5222)AA - A1391 - 1396
8X-RAY DIFFRACTION3chain C and resid 2910:2974AC - C2910 - 2974
9X-RAY DIFFRACTION4chain C and resid 2975:3059AC - C2975 - 3059
10X-RAY DIFFRACTION5chain C and (resid 2009:2101 or resid 2151:2226)AC - C2009 - 2101
11X-RAY DIFFRACTION5chain C and (resid 2009:2101 or resid 2151:2226)AC - C2151 - 2226
12X-RAY DIFFRACTION6chain C and resid 2102:2150AC - C2102 - 2150
13X-RAY DIFFRACTION7(chain A and (resid 926:986 or resid 1048:1390)) or (chain C and (resid 2302:2507 or resid 4202:4352 or resid 4604:4730 or resid 5402:5515 or resid 5601:5701 or resid 6203:6281))AA - A926 - 986
14X-RAY DIFFRACTION7(chain A and (resid 926:986 or resid 1048:1390)) or (chain C and (resid 2302:2507 or resid 4202:4352 or resid 4604:4730 or resid 5402:5515 or resid 5601:5701 or resid 6203:6281))AA - A1048 - 1390
15X-RAY DIFFRACTION8chain A and resid 987:1047AA - A987 - 1047
16X-RAY DIFFRACTION9(chain A and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain C and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AA - A563
17X-RAY DIFFRACTION9(chain A and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain C and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AA - A567 - 913
18X-RAY DIFFRACTION9(chain A and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain C and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AA - A1496 - 1530
19X-RAY DIFFRACTION10chain A and resid 1397:1495AA - A1397 - 1495
20X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D3001 - 3876
21X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D3902 - 4038
22X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D4116 - 4905
23X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D4930 - 5092
24X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D5198 - 5296
25X-RAY DIFFRACTION11(chain D and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain B and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AD - D5322 - 5903
26X-RAY DIFFRACTION12(chain AD and resid 4039:4115) or (chain AB and (resid 8401:8528 or resid 1302:1442))AD4039 - 4115
27X-RAY DIFFRACTION12(chain AD and resid 4039:4115) or (chain AB and (resid 8401:8528 or resid 1302:1442))AB8401 - 8528
28X-RAY DIFFRACTION12(chain AD and resid 4039:4115) or (chain AB and (resid 8401:8528 or resid 1302:1442))AB1302 - 1442
29X-RAY DIFFRACTION13chain AD and resid 4906:4929AD4906 - 4929
30X-RAY DIFFRACTION14(chain AD and resid 5093:5197) or (chain AB and resid 9518:9724)AD5093 - 5197
31X-RAY DIFFRACTION14(chain AD and resid 5093:5197) or (chain AB and resid 9518:9724)AB9518 - 9724
32X-RAY DIFFRACTION15chain AD and resid 3877:3901AD3877 - 3901
33X-RAY DIFFRACTION16(chain AD and resid 5297:5321) or (chain AB and resid 901:1077)AD5297 - 5321
34X-RAY DIFFRACTION16(chain AD and resid 5297:5321) or (chain AB and resid 901:1077)AB901 - 1077
35X-RAY DIFFRACTION17(chain AD and (resid 6002:6069 or resid 6108:6119)) or (chain AB and resid 3002:3117)AD6002 - 6069
36X-RAY DIFFRACTION17(chain AD and (resid 6002:6069 or resid 6108:6119)) or (chain AB and resid 3002:3117)AD6108 - 6119
37X-RAY DIFFRACTION18(chain AD and resid 6070:6107) or (chain AB and resid 5008:5083)AD6070 - 6107
38X-RAY DIFFRACTION18(chain AD and resid 6070:6107) or (chain AB and resid 5008:5083)AB5008 - 5083
39X-RAY DIFFRACTION19chain AB and resid 8048:8148AB8048 - 8148
40X-RAY DIFFRACTION20(chain AE and (resid 2:8 or resid 27:557)) or (chain AF and (resid 2602:2806 or resid 5901:5982 or resid 6303:6387 or resid 5223:5324 or resid 6004:6083))AE2 - 8
41X-RAY DIFFRACTION20(chain AE and (resid 2:8 or resid 27:557)) or (chain AF and (resid 2602:2806 or resid 5901:5982 or resid 6303:6387 or resid 5223:5324 or resid 6004:6083))AE27 - 557
42X-RAY DIFFRACTION21(chain AE and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain AF and resid 5202:5222)AE9 - 26
43X-RAY DIFFRACTION21(chain AE and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain AF and resid 5202:5222)AE558 - 562
44X-RAY DIFFRACTION21(chain AE and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain AF and resid 5202:5222)AE564 - 566
45X-RAY DIFFRACTION21(chain AE and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain AF and resid 5202:5222)AE914 - 925
46X-RAY DIFFRACTION21(chain AE and (resid 9:26 or resid 558:562 or resid 564:566 or resid 914:925 or resid 1391:1396)) or (chain AF and resid 5202:5222)AE1391 - 1396
47X-RAY DIFFRACTION22chain AF and resid 2910:2974AF2910 - 2974
48X-RAY DIFFRACTION23chain AF and resid 2975:3059AF2975 - 3059
49X-RAY DIFFRACTION24chain AF and (resid 2009:2101 or resid 2151:2226)AF2009 - 2101
50X-RAY DIFFRACTION24chain AF and (resid 2009:2101 or resid 2151:2226)AF2151 - 2226
51X-RAY DIFFRACTION25chain AF and resid 2102:2150AF2102 - 2150
52X-RAY DIFFRACTION26(chain AE and (resid 926:986 or resid 1048:1390)) or (chain AF and (resid 2302:2507 or resid 4202:4352 or resid 4604:4730 or resid 5402:5515 or resid 5601:5701 or resid 6203:6281))AE926 - 986
53X-RAY DIFFRACTION26(chain AE and (resid 926:986 or resid 1048:1390)) or (chain AF and (resid 2302:2507 or resid 4202:4352 or resid 4604:4730 or resid 5402:5515 or resid 5601:5701 or resid 6203:6281))AE1048 - 1390
54X-RAY DIFFRACTION27chain AE and resid 987:1047AE987 - 1047
55X-RAY DIFFRACTION28(chain AE and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain AF and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AE563
56X-RAY DIFFRACTION28(chain AE and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain AF and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AE567 - 913
57X-RAY DIFFRACTION28(chain AE and (resid 563 or resid 567:913 or resid 1496:1530)) or (chain AF and (resid 4001:4100 or resid 4403:4530 or resid 5013:5129 or resid 5802:5889 or resid 7004:7054 or resid 6120:6174))AE1496 - 1530
58X-RAY DIFFRACTION29chain AE and resid 1397:1495AE1397 - 1495
59X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG3001 - 3876
60X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG3902 - 4038
61X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG4116 - 4905
62X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG4930 - 5092
63X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG5198 - 5296
64X-RAY DIFFRACTION30(chain AG and (resid 3001:3876 or resid 3902:4038 or resid 4116:4905 or resid 4930:5092 or resid 5198:5296 or resid 5322:5903)) or (chain AH and not (resid 8048:8148 or resid 8401:8528 or resid 1302:1442 or resid 9518:9724 or resid 901:1077 or resid 3002:3117 or resid 5008:5083))AG5322 - 5903
65X-RAY DIFFRACTION31(chain AG and resid 4039:4115) or (chain AH and (resid 8401:8528 or resid 1302:1442))AG4039 - 4115
66X-RAY DIFFRACTION31(chain AG and resid 4039:4115) or (chain AH and (resid 8401:8528 or resid 1302:1442))AH8401 - 8528
67X-RAY DIFFRACTION31(chain AG and resid 4039:4115) or (chain AH and (resid 8401:8528 or resid 1302:1442))AH1302 - 1442
68X-RAY DIFFRACTION32chain AG and resid 4906:4929AG4906 - 4929
69X-RAY DIFFRACTION33(chain AG and resid 5093:5197) or (chain AH and resid 9518:9724)AG5093 - 5197
70X-RAY DIFFRACTION33(chain AG and resid 5093:5197) or (chain AH and resid 9518:9724)AH9518 - 9724
71X-RAY DIFFRACTION34chain AG and resid 3877:3901AG3877 - 3901
72X-RAY DIFFRACTION35(chain AG and resid 5297:5321) or (chain AH and resid 901:1077)AG5297 - 5321
73X-RAY DIFFRACTION35(chain AG and resid 5297:5321) or (chain AH and resid 901:1077)AH901 - 1077
74X-RAY DIFFRACTION36(chain AG and (resid 6002:6069 or resid 6108:6119)) or (chain AH and resid 3002:3117)AG6002 - 6069
75X-RAY DIFFRACTION36(chain AG and (resid 6002:6069 or resid 6108:6119)) or (chain AH and resid 3002:3117)AG6108 - 6119
76X-RAY DIFFRACTION37(chain AG and resid 6070:6107) or (chain AH and resid 5008:5083)AG6070 - 6107
77X-RAY DIFFRACTION37(chain AG and resid 6070:6107) or (chain AH and resid 5008:5083)AH5008 - 5083
78X-RAY DIFFRACTION38chain AH and resid 8048:8148AH8048 - 8148

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