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Related entries of code: 3qk5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2wapRCSB PDB    PDBbind543aa, >2WAP_1|Chains... at 98%
2wj1RCSB PDB    PDBbind573aa, >2WJ1_1|Chains... at 96%
2wj2RCSB PDB    PDBbind573aa, >2WJ2_1|Chains... at 96%
3k7fRCSB PDB    PDBbind573aa, >3K7F_1|Chains... at 96%
3k83RCSB PDB    PDBbind573aa, >3K83_1|Chains... at 96%
3k84RCSB PDB    PDBbind573aa, >3K84_1|Chains... at 96%
3lj7RCSB PDB    PDBbind573aa, >3LJ7_1|Chains... at 96%
3oj8RCSB PDB    PDBbind573aa, >3OJ8_1|Chains... at 96%
3ppmRCSB PDB    PDBbind573aa, >3PPM_1|Chains... at 96%
3pr0RCSB PDB    PDBbind573aa, >3PR0_1|Chains... at 96%
3qj9RCSB PDB    PDBbind587aa, >3QJ9_1|Chains... *
3qkvRCSB PDB    PDBbind587aa, >3QKV_1|Chains... at 100%
4do3RCSB PDB    PDBbind571aa, >4DO3_1|Chains... at 97%
4hbpRCSB PDB    PDBbind550aa, >4HBP_1|Chains... at 100%
4j5pRCSB PDB    PDBbind573aa, >4J5P_1|Chains... at 96%
6mrgRCSB PDB    PDBbind580aa, >6MRG_1|Chains... at 94%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID3qk5
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameFatty-acid amide hydrolase 1
Ligand NameQK5
EC.Number E.C.3.5.1.99
Resolution 2.2(Å)
Affinity (Kd/Ki/IC50)IC50=18nM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) Bioorg.Med.Chem.Lett. Vol. 21: pp. 2492-2496
Ligand Properties
Formula C27H24N6S
Molecular Weight 464.585
Exact Mass 464.178
No. of atoms 58
No. of bonds 63
Polar Surface Area 98.87
LOGP Value 5.24      (Computed with XLOGP3)
5.99      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 6
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): P97612  
Entrez Gene IDNCBI Entrez Gene ID: 100911581  29347  
ASDInformation of known allosteric effects of PDB entries
 
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