Structure of PDB 6et5 Chain W Binding Site BS04
Receptor Information
>6et5 Chain W (length=55) Species:
1079
(Blastochloris viridis) [
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ADLKPSLTGLTEEEAKEFHGIFVTSTVLYLATAVIVHYLVWTARPWIAPI
PKGWV
Ligand information
Ligand ID
BCB
InChI
InChI=1S/C55H73N4O6.Mg/c1-13-39-34(7)41-29-46-48(38(11)60)36(9)43(57-46)27-42-35(8)40(52(58-42)50-51(55(63)64-12)54(62)49-37(10)44(59-53(49)50)28-45(39)56-41)23-24-47(61)65-26-25-33(6)22-16-21-32(5)20-15-19-31(4)18-14-17-30(2)3;/h13,25,27-32,34-35,40,51H,14-24,26H2,1-12H3,(H-,56,57,58,59,60,62);/q-1;+4/p-1/b33-25+,39-13+;/t31-,32-,34-,35+,40+,51-;/m1./s1
InChIKey
QNWPCDKNPGOYNP-DSENBSCCSA-M
SMILES
Software
SMILES
CACTVS 3.385
COC(=O)[C@H]1C(=O)C2=C(C)C3=CC4=[N@+]5C(=Cc6n7c(C=C8[C@@H](C)[C@H](CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C9=[N@@+]8[Mg]57[N@]3C2=C19)c(C)c6C(C)=O)[C@H](C)\C4=C/C
OpenEye OEToolkits 2.0.7
CC=C1c2cc3c(c4c5n3[Mg]67[n+]2c(cc8n6c(cc9[n+]7c(c5C(C4=O)C(=O)OC)C(C9C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)c(c8C(=O)C)C)C1C)C
OpenEye OEToolkits 2.0.7
C/C=C\1/c2cc3c(c4c5n3[Mg]67[n+]2c(cc8n6c(cc9[n+]7c(c5[C@H](C4=O)C(=O)OC)[C@H]([C@@H]9C)CCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)c(c8C(=O)C)C)C1C)C
CACTVS 3.385
COC(=O)[CH]1C(=O)C2=C(C)C3=CC4=[N+]5C(=Cc6n7c(C=C8[CH](C)[CH](CCC(=O)OCC=C(C)CCC[CH](C)CCC[CH](C)CCCC(C)C)C9=[N+]8[Mg]57[N]3C2=C19)c(C)c6C(C)=O)[CH](C)C4=CC
Formula
C55 H72 Mg N4 O6
Name
BACTERIOCHLOROPHYLL B
ChEMBL
DrugBank
ZINC
PDB chain
6et5 Chain W Residue 101 [
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Receptor-Ligand Complex Structure
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PDB
6et5
Cryo-EM structure of the Blastochloris viridis LH1-RC complex at 2.9 angstrom.
Resolution
2.87 Å
Binding residue
(original residue number in PDB)
Y29 L30 A33 H37 W46
Binding residue
(residue number reindexed from 1)
Y29 L30 A33 H37 W46
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0045156
electron transporter, transferring electrons within the cyclic electron transport pathway of photosynthesis activity
Biological Process
GO:0019684
photosynthesis, light reaction
Cellular Component
GO:0016020
membrane
GO:0030077
plasma membrane light-harvesting complex
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:6et5
,
PDBe:6et5
,
PDBj:6et5
PDBsum
6et5
PubMed
29618818
UniProt
P04124
|LHB_BLAVI Light-harvesting protein B-1015 beta chain (Gene Name=pufB)
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