Structure of PDB 8dq5 Chain B Binding Site BS02

Receptor Information
>8dq5 Chain B (length=265) Species: 986 (Flavobacterium johnsoniae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MSIFDKRVNYKPFEYPEVLQFTEAINKAYWVHTEVDFTADTQDFHAHLSL
AEKTAVKNSLLAIAQIEVAVKSFWGNIYEHFPKPEFNGLGSTFAECEFRH
SEAYSRLLEVLGYNDEFEKLLDVPVIRRRVDYLSNVLKSLILFSILIENV
SLFSQFAILLSFTRFKGYMKNVSNIIAWISIDEQIHANGGIYIINKIRKD
SIAVESDILDWIFEEGEIESIKKGDLVNFMKFRIDESLKQIIFDVKVEDY
KALAWFEEEVFANSL
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain8dq5 Chain B Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8dq5 X-ray crystal structure of Flavobacterium johnsoniae dimanganese(II) class Id ribonucleotide reductase T191I variant
Resolution2.1 Å
Binding residue
(original residue number in PDB)
E97 E160 E195 H198
Binding residue
(residue number reindexed from 1)
E97 E148 E183 H186
Annotation score1
Enzymatic activity
Enzyme Commision number 1.17.4.1: ribonucleoside-diphosphate reductase.
Gene Ontology
Molecular Function
GO:0004748 ribonucleoside-diphosphate reductase activity, thioredoxin disulfide as acceptor
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
Biological Process
GO:0009263 deoxyribonucleotide biosynthetic process
Cellular Component
GO:0016020 membrane

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Cellular Component
External links
PDB RCSB:8dq5, PDBe:8dq5, PDBj:8dq5
PDBsum8dq5
PubMed
UniProtA5FCJ5

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