Structure of PDB 3ifj Chain B Binding Site BS01

Receptor Information
>3ifj Chain B (length=139) Species: 1773 (Mycobacterium tuberculosis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CLAEGTRIFDPVTGTTHRIEDVVDGRKPIHVVAAAKDGTLHARPVVSWFD
QGTRDVIGLRIAGGAIVWATPDHKVLTEYGWRAAGELRKGDRVAVRDVET
GELRYSVIREVLPTRRARTYDLEVEELHTLVAEGVVVHN
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 chain3ifj Chain B Residue 202 [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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PDB3ifj Selection and structure of hyperactive inteins: peripheral changes relayed to the catalytic center.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		E424 H429 X440
Binding residue
(residue number reindexed from 1)		E123 H128 X139
Annotation score4
Enzymatic activity
Enzyme Commision number 3.1.-.-
Gene Ontology
Biological Process
GO:0016539 intein-mediated protein splicing

View graph for
Biological Process
External links
PDB RCSB:3ifj, PDBe:3ifj, PDBj:3ifj
PDBsum3ifj
PubMed19744499
UniProtP9WHJ3|RECA_MYCTU Protein RecA (Gene Name=recA)

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