Structure of PDB 8wm6 Chain s Binding Site BS04
Receptor Information
>8wm6 Chain s (length=154) Species:
52970
(Rhodomonas salina) [
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DTTGFSGVPSQFARPESGVYPAEPTEQTFLGMRGPRAPGHRENFGGKHTA
TMLAIAALLWQPVSEAGMYRMGADGALTKSSFSNMEVPGFGNMKKAPTIE
SLFPFAKNGFDASPALFGKGSMIVVEDPRDGCGAYANSGACHTFLDEIGD
ALKK
Ligand information
Ligand ID
KC2
InChI
InChI=1S/C35H30N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8-14,31H,1-2H2,3-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-2/b11-10+,22-12-,23-13-,24-12-,25-14-,26-13-,27-14-,32-30-;/t31-;/m1./s1
InChIKey
QDRBYWCRXZZVLY-QIEHNWLWSA-L
SMILES
Software
SMILES
OpenEye OEToolkits 2.0.6
Cc1c2cc3nc(c4c5c(c(c6n5[Mg]n2c(c1C=C)cc7nc(c6)C(=C7C)C=C)C)C(=O)C4C(=O)OC)C(=C3C)C=CC(=O)O
CACTVS 3.385
COC(=O)[C@H]1C(=O)c2c(C)c3/C=C/4N=C(/C=C5\[N@]\6[Mg]n3c2/C1=C/7N=C(\C=C\6C(=C5C=C)C)C(=C/7/C=C/C(O)=O)C)C(=C/4C=C)C
OpenEye OEToolkits 2.0.6
Cc1/c/2c/c3n/c(c/4\c5c(c(c/6n5[Mg]n2/c(/c1C=C)c\c7n/c(c6)/C(=C7C)C=C)C)C(=O)[C@@H]4C(=O)OC)/C(=C3C)/C=C/C(=O)O
CACTVS 3.385
COC(=O)[CH]1C(=O)c2c(C)c3C=C4N=C(C=C5[N]6[Mg]n3c2C1=C7N=C(C=C6C(=C5C=C)C)C(=C7C=CC(O)=O)C)C(=C4C=C)C
ACDLabs 12.01
N16C=3C(=C(C1=CC=7C(=C(C(=Cc2n(c5c(c2C)C(C(C(=O)OC)C5=C4C(=C(C(C=3)=N4)C)\C=C\C(=O)O)=O)[Mg]6)N=7)\C=C)C)\C=C)C
Formula
C35 H28 Mg N4 O5
Name
Chlorophyll c2
ChEMBL
DrugBank
ZINC
PDB chain
8wm6 Chain s Residue 204 [
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Receptor-Ligand Complex Structure
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PDB
8wm6
Growth phase-dependent reorganization of cryptophyte photosystem I antennae.
Resolution
2.7 Å
Binding residue
(original residue number in PDB)
L30 G31 R36 H40 R41 F44 H48 T49 M52
Binding residue
(residue number reindexed from 1)
L30 G31 R36 H40 R41 F44 H48 T49 M52
Annotation score
1
External links
PDB
RCSB:8wm6
,
PDBe:8wm6
,
PDBj:8wm6
PDBsum
8wm6
PubMed
38734819
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