Browse entries in the PDBbind-CN Database

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Related entries of code: 1csh
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1csiRCSB PDB    PDBbind435aa, >1CSI_1|Chain... at 93%
1csrRCSB PDB    PDBbind435aa, >1CSR_1|Chain... at 93%
1cssRCSB PDB    PDBbind435aa, >1CSS_1|Chain... at 93%
4ctsRCSB PDB    PDBbind437aa, >4CTS_1|Chains... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID1csh
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namecitrate synthase
Ligand NameAMX
EC.Number E.C.4.1.3.7
Resolution 1.6(Å)
Affinity (Kd/Ki/IC50)Ki=28nM
Release Year1994
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry v33 pp. 7753-9, 1994
Ligand Properties
Formula C23H42N8O17P3
Molecular Weight 795.544
Exact Mass 795.188
No. of atoms 93
No. of bonds 95
Polar Surface Area 439.9
LOGP Value -7.19      (Computed with XLOGP3)
-1.58      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 23
No. of Nitrogen and Oxygen Atoms: 25
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): P23007  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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