Browse entries in the PDBbind-CN Database

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Related entries of code: 1e37
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1bmaRCSB PDB    PDBbind240aa, >1BMA_1|Chain... *
1e34RCSB PDB    PDBbind240aa, >1E34_1|Chain... at 100%
1easRCSB PDB    PDBbind240aa, >1EAS_1|Chain... at 100%
1eatRCSB PDB    PDBbind240aa, >1EAT_1|Chain... at 100%
1elaRCSB PDB    PDBbind240aa, >1ELA_1|Chain... at 100%
1elbRCSB PDB    PDBbind240aa, >1ELB_1|Chain... at 100%
1elcRCSB PDB    PDBbind240aa, >1ELC_1|Chain... at 100%
1eldRCSB PDB    PDBbind240aa, >1ELD_1|Chain... at 100%
1eleRCSB PDB    PDBbind240aa, >1ELE_1|Chain... at 100%
1gvkRCSB PDB    PDBbind240aa, >1GVK_2|Chain... at 100%
1h9lRCSB PDB    PDBbind240aa, >1H9L_2|Chain... at 100%
1incRCSB PDB    PDBbind240aa, >1INC_1|Chain... at 100%
1okxRCSB PDB    PDBbind240aa, >1OKX_1|Chains... at 100%
1qr3RCSB PDB    PDBbind240aa, >1QR3_1|Chain... at 100%
4estRCSB PDB    PDBbind240aa, >4EST_1|Chain... at 100%
4gvuRCSB PDB    PDBbind240aa, >4GVU_1|Chain... at 100%
5estRCSB PDB    PDBbind240aa, >5EST_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1e37
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameelastase
Ligand NameTPY
EC.Number E.C.3.4.21.36
Resolution 1.75(Å)
Affinity (Kd/Ki/IC50)Ki=0.20mM
Release Year2000
Protein/NA SequenceCheck fasta file
Primary Reference Biochem.J. v351 Pt 2 pp. 335-40, 2000
Ligand Properties
Formula C13H16N2O7S
Molecular Weight 344.340
Exact Mass 344.068
No. of atoms 39
No. of bonds 39
Polar Surface Area 154.74
LOGP Value 1.81      (Computed with XLOGP3)
2.79      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 1
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): P00772  
Entrez Gene IDNCBI Entrez Gene ID: 396766  
ASDInformation of known allosteric effects of PDB entries

 
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