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Related entries of code: 1qq9
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1f2oRCSB PDB    PDBbind284aa, >1F2O_1|Chain... *
1f2pRCSB PDB    PDBbind284aa, >1F2P_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1pg2RCSB PDB    PDBbindMET
1wkmRCSB PDB    PDBbindMET
3f3dRCSB PDB    PDBbindMET
4io6RCSB PDB    PDBbindMET
4jblRCSB PDB    PDBbindMET
6ojaRCSB PDB    PDBbindMET
6ahiRCSB PDB    PDBbindMET
Entry Information
PDB ID1qq9
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameaminopeptidase
Ligand NameMET
EC.Number E.C.3.4.11.-
Resolution 1.53(Å)
Affinity (Kd/Ki/IC50)Ki=8.7mM
Release Year2000
Protein/NA SequenceCheck fasta file
Primary Reference Acta Crystallogr., Sect.D v56 pp. 551-8, 2000
Ligand Properties
Formula C5H12NO2S
Molecular Weight 150.219
Exact Mass 150.059
No. of atoms 21
No. of bonds 20
Polar Surface Area 90.24
LOGP Value -1.47      (Computed with XLOGP3)
-0.57      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 0
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): P80561  
Entrez Gene IDNCBI Entrez Gene ID: 6210128  
ASDInformation of known allosteric effects of PDB entries
 
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