Structure of PDB 7rab Chain A Binding Site BS01

Receptor Information
>7rab Chain A (length=299) Species: 186192 (Marinithermus hydrothermalis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GFDPYAFLTHWETGEVSTLPSGQTLREFNIVAVDKEIEIAPGVYFPAWTY
NGQVPGPTLRVTEGDRVRVHFHNAGSHPHTIHFHGIHPASMDGVPGTGPG
MIYPGESFTYEFDAYPFGCHLYHCHAIPLKRHIHKGLYGAFIIDPDPERH
PEYQAAARARLLGTPENQAWQEFVMVMNGFDTNFDEENEVYAVNTVAHAY
MKRPIRIERDRPVRIYLINATEFDPINSFHLHANFFDYYDHGTTLTPTLK
TVDTIMQCQGQRGILEFSFNGFEPGLYMFHAHQSEFAELGWMGNFEVIE
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 chain7rab Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7rab Crystal structures of a dodecameric multicopper oxidase from Marinithermus hydrothermalis.
Resolution1.92 Å
Binding residue
(original residue number in PDB)		H139 C184 H192
Binding residue
(residue number reindexed from 1)		H79 C124 H132
Annotation score1
Enzymatic activity
Enzyme Commision number 1.7.2.1: nitrite reductase (NO-forming).
Gene Ontology
Molecular Function
GO:0005507 copper ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
GO:0050421 nitrite reductase (NO-forming) activity

View graph for
Molecular Function
External links
PDB RCSB:7rab, PDBe:7rab, PDBj:7rab
PDBsum7rab
PubMed34605435
UniProtF2NNS0

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