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Related entries of code: 3iu7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3iu8RCSB PDB    PDBbind288aa, >3IU8:A|PDBID|CHAIN|... at 100%
3iu9RCSB PDB    PDBbind288aa, >3IU9:A|PDBID|CHAIN|... at 100%
3pkaRCSB PDB    PDBbind285aa, >3PKA:A|PDBID|CHAIN|... at 100%
3pkbRCSB PDB    PDBbind285aa, >3PKB:A|PDBID|CHAIN|... at 100%
3pkcRCSB PDB    PDBbind285aa, >3PKC:A|PDBID|CHAIN|... at 100%
3pkdRCSB PDB    PDBbind285aa, >3PKD:A|PDBID|CHAIN|... at 100%
3pkeRCSB PDB    PDBbind285aa, >3PKE:A|PDBID|CHAIN|... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1xnzRCSB PDB    PDBbindFCD

Entry Information
PDB ID3iu7
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameM. tuberculosis methionine aminopeptidase
Ligand NameFCD
EC.Number E.C.3.4.11.18
Resolution 1.4(Å)
Affinity (Kd/Ki/IC50)IC50=16uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference(2010) J.Med.Chem. Vol. 53: pp. 1329-1337
Ligand Properties
Formula C11H7ClO3
Molecular Weight 222.624
Exact Mass 222.008
No. of atoms 22
No. of bonds 23
Polar Surface Area 50.44
LOGP Value 3.92      (Computed with XLOGP3)
3.30      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P9WK19  
Entrez Gene IDNCBI Entrez Gene ID: 888596  
ASDInformation of known allosteric effects of PDB entries

 
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