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Related entries of code: 3v7s
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3v7cRCSB PDB    PDBbind329aa, >3V7C_1|Chain... at 99%
4dq2RCSB PDB    PDBbind328aa, >4DQ2_1|Chain... at 99%
6apwRCSB PDB    PDBbind329aa, >6APW_1|Chain... at 99%
6aqqRCSB PDB    PDBbind329aa, >6AQQ_1|Chain... at 99%
6ndlRCSB PDB    PDBbind330aa, >6NDL_1|Chain... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID3v7s
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameBiotin ligase
Ligand Name36F
EC.Number E.C.-.-.-.-
Resolution 3.1(Å)
Affinity (Kd/Ki/IC50)Ki=0.09uM
Release Year2012
Protein/NA SequenceCheck fasta file
Primary Reference (2012) J.Biol.Chem. Vol. 287: pp. 17823-17832
Ligand Properties
Formula C24H32N6O3S
Molecular Weight 484.614
Exact Mass 484.226
No. of atoms 66
No. of bonds 70
Polar Surface Area 132.28
LOGP Value 3.24      (Computed with XLOGP3)
3.90      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
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 ACNo matched UniProt accession number (AC) found!
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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