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Related entries of code: 2h3e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1d09RCSB PDB    PDBbind153aa, >1D09_2|Chains... *
1q95RCSB PDB    PDBbind153aa, >1Q95_2|Chains... at 100%
2fzcRCSB PDB    PDBbind153aa, >2FZC_2|Chains... at 100%
2fzgRCSB PDB    PDBbind153aa, >2FZG_2|Chains... at 100%
2fzkRCSB PDB    PDBbind153aa, >2FZK_2|Chains... at 100%
2ipoRCSB PDB    PDBbind153aa, >2IPO_2|Chains... at 100%
3at1RCSB PDB    PDBbind153aa, >3AT1_2|Chains... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID2h3e
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameaspartate carbamoyltransferase
Ligand Name6PR
EC.Number E.C.2.1.3.2
Resolution 2.3(Å)
Affinity (Kd/Ki/IC50)Kd=2uM
Release Year2006
Protein/NA SequenceCheck fasta file
Primary Reference J.Med.Chem. v49 pp. 5932-8, 2006
Ligand Properties
Formula C6H12N2O7P
Molecular Weight 255.142
Exact Mass 255.038
No. of atoms 28
No. of bonds 27
Polar Surface Area 183.77
LOGP Value -2.50      (Computed with XLOGP3)
-1.74      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 9
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): P0A786  P0A7F3  
Entrez Gene IDNCBI Entrez Gene ID: 61753903  948767  61753902  948763  
ASDInformation of known allosteric effects of PDB entries

 
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