Structure of PDB 7e64 Chain A Binding Site BS01

Receptor Information
>7e64 Chain A (length=255) Species: 197 (Campylobacter jejuni) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MELIKGQALFLELDKKDFLSLKNNDKNIPTFAHPKNQEKILAIFSLPYKN
PPQNTKLIAFYKDKKEEIFIKTLEGNYKSEKLQVENKKIFPPKTIQERIA
KELKEANAIYSSYTPKALFNGAFNIPLNSFITSDFGKARTFNEKVASYHS
GTDFRAATGTPIYAANSGVVKIAKDRYFAGNSVVIDHGFGIYSQYYHLSK
IDVKVGQKIKKGELIGLSGASGRVSGPALHFGILAGGKQVDPLDFVSKFN
AIFQL
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain7e64 Chain A Residue 300 [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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PDB7e64 Structure-based inhibitor design for reshaping bacterial morphology
Resolution2.9 Å
Binding residue
(original residue number in PDB)		H168 D172 H249
Binding residue
(residue number reindexed from 1)		H149 D153 H230
Annotation score4
External links