Structure of PDB 6vat Chain C Binding Site BS03

Receptor Information
>6vat Chain C (length=345) Species: 2583588 (Salmonella enterica subsp. enterica serovar 1,4,[5],12:i:-) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AVSVQYPLSNLHYRDMGTGQNVLLITVDGLNYSRFEKQMPELATFAEQNI
DFTRHMSSGNTTDNGIFGLFYGISPGYMDGVLSTRTPAALITALNQQGYQ
LGLFSSDGFASPLYRQALLSDFSMPAAQTQSDAQTASQWIDWLGRYAQED
NRWFSWISFNGTNIDDSNQKNFVKRYASAASDVDAQINRVLNALREAGKF
DNTVVIITAGRGIPLTPEENRFDWSQGHLQVPLVIHWPGTPAQRINVLTD
HTDVMTTLMQRLLHVSTPANEYSQGQDIFTVPRRHNWVTAADGSTLAITT
PQMTLVLNNNGHYQTYDLHGEKIKDQKPQLSLLLQVLTEEKRFIA
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain6vat Chain C Residue 608 [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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PDB6vat The essential inner membrane protein YejM is a metalloenzyme.
Resolution2.35 Å
Binding residue
(original residue number in PDB)		Y553 L570
Binding residue
(residue number reindexed from 1)		Y313 L330
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:6vat, PDBe:6vat, PDBj:6vat
PDBsum6vat
PubMed33082366
UniProtP40709|YEJM_SALTY Inner membrane protein YejM (Gene Name=yejM)

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