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Related entries of code: 4bnv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4bntRCSB PDB    PDBbind269aa, >4BNT_1|Chains... *
4bnuRCSB PDB    PDBbind269aa, >4BNU_1|Chains... at 100%
4bnxRCSB PDB    PDBbind269aa, >4BNX_1|Chains... at 100%
4bnyRCSB PDB    PDBbind269aa, >4BNY_1|Chains... at 100%
4bnzRCSB PDB    PDBbind269aa, >4BNZ_1|Chains... at 100%
4bo0RCSB PDB    PDBbind269aa, >4BO0_1|Chains... at 100%
4bo1RCSB PDB    PDBbind269aa, >4BO1_1|Chains... at 100%
4bo2RCSB PDB    PDBbind269aa, >4BO2_1|Chains... at 100%
4bo3RCSB PDB    PDBbind269aa, >4BO3_1|Chains... at 100%
4bo4RCSB PDB    PDBbind269aa, >4BO4_1|Chains... at 100%
4bo5RCSB PDB    PDBbind269aa, >4BO5_1|Chains... at 100%
4bo6RCSB PDB    PDBbind269aa, >4BO6_1|Chains... at 100%
4bo7RCSB PDB    PDBbind269aa, >4BO7_1|Chains... at 100%
4bo8RCSB PDB    PDBbind269aa, >4BO8_1|Chains... at 100%
4bo9RCSB PDB    PDBbind269aa, >4BO9_1|Chains... 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 ID4bnv
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Name3-OXOACYL-[ACYL-CARRIER-PROTEIN] REDUCTASE FABG
Ligand NameQ7U
EC.Number E.C.1.1.1.100
Resolution 2.5(Å)
Affinity (Kd/Ki/IC50)IC50=0.03uM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2013) Acs Chem.Biol. Vol. 8: pp. 2518-2527
Ligand Properties
Formula C15H13ClN4O
Molecular Weight 300.743
Exact Mass 300.078
No. of atoms 34
No. of bonds 36
Polar Surface Area 58.95
LOGP Value 2.96      (Computed with XLOGP3)
4.02      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
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): O54438  
Entrez Gene IDNCBI Entrez Gene ID: 880433  
ASDInformation of known allosteric effects of PDB entries

 
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