Structure of PDB 7y7a Chain WQ Binding Site BS02
Receptor Information
>7y7a Chain WQ (length=164) Species:
35688
(Porphyridium purpureum) [
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MKSVITTVVSAADAAGRFPSNSDLESIQGNIQRSAARLEAAEKLAGNHEA
VVKEAGDACFAKYAYLKNPGEAGENQEKINKCYRDVDHYMRLVNYCLVVG
GTGPLDEWGIAGAREVYRTLNLPTSAYVASIAYTRDRLCVPRDMSAQAGV
EFSAYLDYLINALS
Ligand information
Ligand ID
PEB
InChI
InChI=1S/C33H40N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h8,14-15,19-20,26,34H,2,7,9-13H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b27-14-,29-15-/t19-,20-,26-/m1/s1
InChIKey
NKCBCVIFPXGHAV-WAVSMFBNSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
CCC1C(C(=O)NC1=CC2=NC(=Cc3c(c(c([nH]3)CC4C(=C(C(=O)N4)C=C)C)C)CCC(=O)O)C(=C2C)CCC(=O)O)C
OpenEye OEToolkits 1.5.0
CC[C@@H]\1[C@H](C(=O)N/C1=C\C2=N/C(=C\c3c(c(c([nH]3)C[C@@H]4C(=C(C(=O)N4)C=C)C)C)CCC(=O)O)/C(=C2C)CCC(=O)O)C
CACTVS 3.341
CC[C@@H]1[C@@H](C)C(=O)N\C1=C/C2=N\C(=C/c3[nH]c(C[C@H]4NC(=O)C(=C4C)C=C)c(C)c3CCC(O)=O)C(=C2C)CCC(O)=O
CACTVS 3.341
CC[CH]1[CH](C)C(=O)NC1=CC2=NC(=Cc3[nH]c(C[CH]4NC(=O)C(=C4C)C=C)c(C)c3CCC(O)=O)C(=C2C)CCC(O)=O
Formula
C33 H40 N4 O6
Name
PHYCOERYTHROBILIN
ChEMBL
DrugBank
ZINC
ZINC000058633585
PDB chain
7y7a Chain WQ Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
7y7a
In situ structure of the red algal phycobilisome-PSII-PSI-LHC megacomplex.
Resolution
4.3 Å
Binding residue
(original residue number in PDB)
K78 K81 C82 R84 D85 H88 Y89 W108 L122 Y127
Binding residue
(residue number reindexed from 1)
K78 K81 C82 R84 D85 H88 Y89 W108 L122 Y127
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Biological Process
GO:0015979
photosynthesis
Cellular Component
GO:0009507
chloroplast
GO:0009535
chloroplast thylakoid membrane
GO:0009579
thylakoid
GO:0016020
membrane
GO:0030089
phycobilisome
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:7y7a
,
PDBe:7y7a
,
PDBj:7y7a
PDBsum
7y7a
PubMed
36922595
UniProt
P11392
|PHEA_PORPP B-phycoerythrin alpha chain (Gene Name=cpeA)
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