Browse entries in the PDBbind-CN Database

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Related entries of code: 1t31
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2hvxRCSB PDB    PDBbind226aa, >2HVX_1|Chain... at 100%
3n7oRCSB PDB    PDBbind226aa, >3N7O_1|Chain... at 99%
3s0nRCSB PDB    PDBbind226aa, >3S0N_1|Chain... at 100%
4k2yRCSB PDB    PDBbind226aa, >4K2Y_1|Chain... at 100%
4k5zRCSB PDB    PDBbind226aa, >4K5Z_1|Chain... at 100%
4k60RCSB PDB    PDBbind226aa, >4K60_1|Chain... at 100%
4k69RCSB PDB    PDBbind226aa, >4K69_1|Chain... at 100%
4kp0RCSB PDB    PDBbind226aa, >4KP0_1|Chain... at 98%
5yjmRCSB PDB    PDBbind226aa, >5YJM_1|Chain... at 98%
5yjpRCSB PDB    PDBbind226aa, >5YJP_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1t32RCSB PDB    PDBbindOHH
Entry Information
PDB ID1t31
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namechymase
Ligand NameOHH
EC.Number E.C.3.4.21.39
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=2.3nM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v280 pp. 18001-7, 2005
Ligand Properties
Formula C40H36N2O6P
Molecular Weight 671.697
Exact Mass 671.231
No. of atoms 85
No. of bonds 91
Polar Surface Area 131.97
LOGP Value 6.26      (Computed with XLOGP3)
7.12      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 7
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): P23946  
Entrez Gene IDNCBI Entrez Gene ID: 1215  
ASDInformation of known allosteric effects of PDB entries
 
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