Structure of PDB 8wql Chain a1 Binding Site BS01

Receptor Information
>8wql Chain a1 (length=334) Species: 153964 (Arthrospira sp. FACHB-439) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LNIWEQFCGWVTSTNNRLYVGWFGIVMIPTLLTATICFVLAFVAAPPVDI
DGIREPVSGSLLYGNNIITAAVVPSSNAIGLHFYPIWEAANIDEWLYNGG
PYQLIVFHFLIGIFCYMGREWELSYRLGMRPWIAVAYSAPVAAATAVLLV
YSIGQGSFSDGLPLGISGTFNFMLVLQAEHNVLMHPFHMLGVAGVFGGAL
FSAMHGSLVTSSLVRETTEIESQNRGYRFGQEEETYNIVAAHGYFGRLIF
QYASFNNSRALHFFLGAWPVVGIWFASLAVACFAFNLNGFNFNHSVLDSQ
GKVLNTWADVINRANLGIEAMHERNVHNFPLDLA
Ligand information
Ligand IDOEX
InChIInChI=1S/Ca.4Mn.5O
InChIKeySEXWDHMBWJEXOJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.370O12|[Ca]3O4|[Mn]1O5|[Mn]2[O]36[Mn]O[Mn@]456
CACTVS 3.370O12|[Ca]3O4|[Mn]1O5|[Mn]2[O]36[Mn]O[Mn]456
OpenEye OEToolkits 1.7.0O1[Mn]O23[Mn]14O5[Ca]2O6[Mn]5O4[Mn]36
OpenEye OEToolkits 1.7.0O1[Mn][O@]23[Mn@@]14[O@]5[Ca]2[O@@]6[Mn]5[O@]4[Mn]36
FormulaCa Mn4 O5
NameCA-MN4-O5 CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain8wql Chain a1 Residue 402 [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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PDB8wql Structure of in situ PBS-PSII supercomplex at 3.5 Angstroms resolution.
Resolution3.5 Å
Binding residue
(original residue number in PDB)		D170 E189 H332 E333 D342 A344
Binding residue
(residue number reindexed from 1)		D160 E179 H322 E323 D332 A334
Annotation score4
External links