Structure of PDB 6sf5 Chain B Binding Site BS01

Receptor Information
>6sf5 Chain B (length=296) Species: 360293 (Leeuwenhoekiella blandensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TNIFEKRINLKPYEYPELNEYVAAIRHSYWIHTEFNFTSDIQDFKTGLSE
VERSAIKNTMLAISQIEVAVKTFWGDVHHRLPKPEIAAVGATFAESEVRH
HDAYSHLLEILGLNEEFKELKKKPVIMKRVHYLETSLKHAKSDDDREYTE
SILLFALFIEHVSLFSQFLIIMAFNKHKNMLKGISNAVEATSKEEQIHGD
FGVDIINIIKKENPEWFDEEHNNLIKEMCLNSFEAESKVVDWIFEKGELD
FLPKAVINEFLKNRFNKSLEAIGLEKLFDIDEALLQETEWFDDEII
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 chain6sf5 Chain B Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6sf5 Class Id ribonucleotide reductase utilizes a Mn2(IV,III) cofactor and undergoes large conformational changes on metal loading.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		E170 E200 H203 E298
Binding residue
(residue number reindexed from 1)		E67 E97 H100 E195
Annotation score1
Enzymatic activity
Enzyme Commision number 1.17.4.1: ribonucleoside-diphosphate reductase.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
Biological Process
GO:0009263 deoxyribonucleotide biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:6sf5, PDBe:6sf5, PDBj:6sf5
PDBsum6sf5
PubMed31414238
UniProtA3XHF9

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