Structure of PDB 7lj0 Chain B Binding Site BS03
Receptor Information
>7lj0 Chain B (length=145) Species:
35688
(Porphyridium purpureum) [
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DGNKRLDAVNSIVSNASCMVSDAVSGMICENPGLISPGGNCYTNRRMAAC
LRDGEIILRYVSYALLAGDASVLEDRCLNGLKETYIALGVPTNSSIRAVS
IMKAQAVAFITNTATERKMSFAAGDCTSLASEVASYFDRVGAAIS
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
7lj0 Chain B Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
7lj0
Scaffolding proteins guide the evolution of algal light harvesting antennas.
Resolution
2.8 Å
Binding residue
(original residue number in PDB)
N35 K36 L38 D39 I142 F153 A154 A155 G156 C158
Binding residue
(residue number reindexed from 1)
N3 K4 L6 D7 I110 F121 A122 A123 G124 C126
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:7lj0
,
PDBe:7lj0
,
PDBj:7lj0
PDBsum
7lj0
PubMed
33767155
UniProt
P11393
|PHEB_PORPP B-phycoerythrin beta chain (Gene Name=cpeB)
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