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Related entries of code: 3iu9
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3iu7RCSB PDB    PDBbind288aa, >3IU7_1|Chain... *
3iu8RCSB PDB    PDBbind288aa, >3IU8_1|Chain... at 100%
3pkaRCSB PDB    PDBbind285aa, >3PKA_1|Chain... at 100%
3pkbRCSB PDB    PDBbind285aa, >3PKB_1|Chain... at 100%
3pkcRCSB PDB    PDBbind285aa, >3PKC_1|Chain... at 100%
3pkdRCSB PDB    PDBbind285aa, >3PKD_1|Chain... at 100%
3pkeRCSB PDB    PDBbind285aa, >3PKE_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID3iu9
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameM. tuberculosis methionine aminopeptidase
Ligand NameT07
EC.Number E.C.3.4.11.18
Resolution 1.75(Å)
Affinity (Kd/Ki/IC50)IC50=0.24uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) J.Med.Chem. Vol. 53: pp. 1329-1337
Ligand Properties
Formula C9H8Cl2N4S
Molecular Weight 275.158
Exact Mass 273.985
No. of atoms 24
No. of bonds 25
Polar Surface Area 92.89
LOGP Value 3.23      (Computed with XLOGP3)
3.57      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 4
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: 45426848  888596  
ASDInformation of known allosteric effects of PDB entries

 
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