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Structure of PDB 7uea Chain A Binding Site BS21

Receptor Information
>7uea Chain A (length=645) Species: 194439 (Chlorobaculum tepidum TLS) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
STKWYQIFDTEKLDDEQVVGGHLALLGVLGFIMGIYYISGIQVFPWGAPG
FHDNWFYLTIKPRMVSLGIDTYSTKTADLEAAGARLLGWAAFHFLVGSVL
IFGGWRHWTHNLTNPFTGRCGNFRDFRFLGKFGDVVFNGTSAKSYKEALG
PHAVYMSLLFLGWGIVMWAILGFAPIPDFQTINSETFMSFVFAVIFFALG
IYWWNNPPNAAIHLNDDMKAAFSVHLTAIGYINIALGCIAFVAFQQPSFA
PYYKELDKLVFYLYGEPFNRVSFNFVEQAKEFADFPAYAILPKSGEAFGM
ARVVTNLIVFNHIICGVLYVFAGVYHGGQYLLKIQLNGMYNQIKSIWITK
GRDQEVQVKILGTVMALCFATMLSVYAVIVWNTICELNIFGTNITMSFYW
LKPLPIFQWMFADPSINDWVMAHVITAGSLFSLIALVRIAFFAHTSPLWD
DLGLKKNSYSFPCLGPVYGGTCGVSIQDQLWFAMLWGIKGLSAVCWYIDG
AWIASMMYGVPAADAKAWDSIAHLHHHYTSGIFYYFWTETVTIFSSSHLS
TILMIGHLVWFISFAVWFEDRGSRLEGADIQTRTIRWLGKKFLNRDVNFR
FPVLTISDSKLAGTFLYFGGTFMLVFLFLANGFYQTNSPLPPPVS
Ligand information
Ligand IDGS0
InChIInChI=1S/C55H75N4O6.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;/h25,27-32,34-35,39-40,51H,13-24,26H2,1-12H3,(H-,56,57,58,59,60,62);/q-1;+2/p-1/b33-25+;/t31-,32-,34?,35?,39?,40?,51+;/m1./s1
InChIKeyDSJXIQQMORJERS-NDWDOOJPSA-M
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7CC[C@@H]1[C@H](C2=Cc3c(c(c4n3[Mg]56[N]2=C1C=C7N5C8=C([C@@H](C(=O)C8=C7C)C(=O)OC)C9=[N]6C(=C4)[C@H]([C@@H]9CCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C)C)C(=O)C)C
CACTVS 3.385CC[C@@H]1[C@H](C)C2=Cc3n4[Mg][N@]5C(=CC1=N2)C(=C6C(=O)[C@@H](C(=O)OC)C(=C56)C7=NC(=Cc4c(C)c3C(C)=O)[C@@H](C)[C@@H]7CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C
OpenEye OEToolkits 2.0.7CCC1C(C2=Cc3c(c(c4n3[Mg]56[N]2=C1C=C7N5C8=C(C(C(=O)C8=C7C)C(=O)OC)C9=[N]6C(=C4)C(C9CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C)C(=O)C)C
CACTVS 3.385CC[CH]1[CH](C)C2=Cc3n4[Mg][N]5C(=CC1=N2)C(=C6C(=O)[CH](C(=O)OC)C(=C56)C7=NC(=Cc4c(C)c3C(C)=O)[CH](C)[CH]7CCC(=O)OCC=C(C)CCC[CH](C)CCC[CH](C)CCCC(C)C)C
FormulaC55 H74 Mg N4 O6
NameBacteriochlorophyll A isomer
ChEMBL
DrugBank
ZINC
PDB chain7uea Chain a Residue 804 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7uea Molecular asymmetry of a photosynthetic supercomplex from green sulfur bacteria.
Resolution3.49 Å
Binding residue
(original residue number in PDB)		F597 F600 W601
Binding residue
(residue number reindexed from 1)		F533 F536 W537
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0009579 thylakoid
GO:0016020 membrane

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Biological Process
View graph for
Cellular Component
External links

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