Browse entries in the PDBbind-CN Database

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Related entries of code: 4cts
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1cshRCSB PDB    PDBbind435aa, >1CSH_1|Chain... at 93%
1csiRCSB PDB    PDBbind435aa, >1CSI_1|Chain... at 93%
1csrRCSB PDB    PDBbind435aa, >1CSR_1|Chain... at 93%
1cssRCSB PDB    PDBbind435aa, >1CSS_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3p4qRCSB PDB    PDBbindOAA

Entry Information
PDB ID4cts
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namecitrate synthase
Ligand NameOAA
EC.Number E.C.4.1.3.7
Resolution 2.9(Å)
Affinity (Kd/Ki/IC50)Kd<10uM
Release Year1984
Protein/NA SequenceCheck fasta file
Primary Reference J.Mol.Biol. v174 pp. 205-19, 1984
Ligand Properties
Formula C4H4O5
Molecular Weight 132.072
Exact Mass 132.006
No. of atoms 13
No. of bonds 12
Polar Surface Area 91.67
LOGP Value 1.13      (Computed with XLOGP3)
-0.89      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 5
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): P00889  
Entrez Gene IDNCBI Entrez Gene ID: 397519  
ASDInformation of known allosteric effects of PDB entries

 
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