Structure of PDB 8s2q Chain A Binding Site BS01

Receptor Information
>8s2q Chain A (length=333) Species: 376 (Bradyrhizobium sp.) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LKLPRQKVELVAPPFVHAHEQATKQGPKIVEFKLTIEEKKVVIDEKGTTF
QAMTFNGSMPGPLMVVHEGDYVETTLVNPATNTMPHNIDFHSATGALGGG
ALTLINPGEQVVLRWKATKTGVFVYHCAPGGPMIPWHVVSGMNGAVMVLP
RDGLNDGKGHALKYDKVYYVGEQDMYVPRDEKGNFKSYDSPGEAFTDTEE
MMKKLIPSHVVFNGKVGALTGKNALTANVGENVLIVHSQANRDSRPHLIG
GHGDYVWETGKFGNAPEVGLETWFIRGGSAGAAMYKFMQPGIYAYVTHNL
IEAADLGATAHFKVEGKWNDDLMTQVKAPAEIP
Ligand information
Ligand IDCU
InChIInChI=1S/Cu/q+2
InChIKeyJPVYNHNXODAKFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Cu+2]
CACTVS 3.341[Cu++]
FormulaCu
NameCOPPER (II) ION
ChEMBL
DrugBankDB14552
ZINC
PDB chain8s2q Chain A Residue 401 [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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PDB8s2q Spectroscopically validated pH-dependent MSOX movies provide detailed mechanism of copper nitrite reductases.
Resolution1.05 Å
Binding residue
(original residue number in PDB)		H89 C130 H140 M145
Binding residue
(residue number reindexed from 1)		H86 C127 H137 M142
Annotation score1
External links