Structure of PDB 7xrf Chain C Binding Site BS01

Receptor Information
>7xrf Chain C (length=323) Species: 498716 (human intestinal bacterium PUE) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SNVKLGVTLYSFSTEYCQGKMTLEDCIRTAKELGAAGFEIVATQMIPSYP
YVSDKFLGELKSICQYYDMEPVCYGANCDRGLRGDRNLTGDEMVAMAVRD
IKNAHKMGCKVVREQWLMGPENFAKLAPFAEHYGVKVGIEVHNPETPITQ
STKDYIAAIDKTGSKYLGLIPDFGCFANKPNKMNWDNALADGADKKLLEM
ARDMKYDNVPYDEAVKRLTAAGAKKVELTTMRDMYTFLTFKKDVSAELQG
LKDMIPYCIHMHGKYHYMYENLQEAAIPYDDIMKIVSESDYDGYIVSEYE
EYNSGHSIEMLRRHLKMMHNFVD
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 chain7xrf Chain C 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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PDB7xrf Structural mechanism of a dual-functional enzyme DgpA/B/C as both a C-glycoside cleaving enzyme and an O- to C-glycoside isomerase.
Resolution2.137 Å
Binding residue
(original residue number in PDB)		E141 D173 H263 E299
Binding residue
(residue number reindexed from 1)		E140 D172 H262 E298
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:7xrf, PDBe:7xrf, PDBj:7xrf
PDBsum7xrf
PubMed36815035
UniProtA0A3Q9WXL1

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