Browse entries in the PDBbind-CN Database

Display Options: Structure:  




Goto PDB code:

3D presentation of molecule is powered by 3Dmol, which supports all modern browsers and mobile devices via WebGL.

           
Hold mouse button: left to rotate,middle to shift,right to zoom

Related entries of code: 1epq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1eedRCSB PDB    PDBbind330aa, >1EED_1|Chain... at 100%
1entRCSB PDB    PDBbind330aa, >1ENT_1|Chain... at 100%
1epoRCSB PDB    PDBbind330aa, >1EPO_1|Chain... at 100%
1eppRCSB PDB    PDBbind330aa, >1EPP_1|Chain... at 100%
1gvuRCSB PDB    PDBbind330aa, >1GVU_1|Chain... at 100%
1gvwRCSB PDB    PDBbind330aa, >1GVW_1|Chain... at 100%
1gvxRCSB PDB    PDBbind330aa, >1GVX_1|Chain... at 100%
2er0RCSB PDB    PDBbind330aa, >2ER0_1|Chain... at 100%
2er6RCSB PDB    PDBbind330aa, >2ER6_1|Chain... at 100%
2er9RCSB PDB    PDBbind330aa, >2ER9_1|Chain... at 100%
2v00RCSB PDB    PDBbind330aa, >2V00_1|Chain... at 100%
3er3RCSB PDB    PDBbind330aa, >3ER3_1|Chain... at 100%
3er5RCSB PDB    PDBbind330aa, >3ER5_1|Chain... at 100%
3prsRCSB PDB    PDBbind330aa, >3PRS_1|Chain... at 100%
3pwwRCSB PDB    PDBbind330aa, >3PWW_1|Chain... at 100%
3uriRCSB PDB    PDBbind330aa, >3URI_1|Chain... at 100%
3wz6RCSB PDB    PDBbind330aa, >3WZ6_1|Chain... at 100%
3wz7RCSB PDB    PDBbind330aa, >3WZ7_1|Chain... at 100%
3wz8RCSB PDB    PDBbind330aa, >3WZ8_1|Chain... at 100%
4er1RCSB PDB    PDBbind330aa, >4ER1_1|Chain... at 100%
4er2RCSB PDB    PDBbind330aa, >4ER2_1|Chain... at 100%
4er4RCSB PDB    PDBbind330aa, >4ER4_1|Chain... at 100%
4kupRCSB PDB    PDBbind330aa, >4KUP_1|Chain... at 100%
4lp9RCSB PDB    PDBbind330aa, >4LP9_1|Chain... at 100%
4y38RCSB PDB    PDBbind330aa, >4Y38_1|Chain... at 100%
4y3jRCSB PDB    PDBbind330aa, >4Y3J_1|Chain... at 100%
4y3yRCSB PDB    PDBbind330aa, >4Y3Y_1|Chain... at 100%
4y4gRCSB PDB    PDBbind330aa, >4Y4G_1|Chain... at 100%
4y4jRCSB PDB    PDBbind330aa, >4Y4J_1|Chain... at 100%
4ze6RCSB PDB    PDBbind330aa, >4ZE6_1|Chain... at 100%
5er1RCSB PDB    PDBbind330aa, >5ER1_1|Chain... at 100%
5er2RCSB PDB    PDBbind330aa, >5ER2_1|Chain... at 100%
5hctRCSB PDB    PDBbind419aa, >5HCT_1|Chain... *
5lwsRCSB PDB    PDBbind330aa, >5LWS_1|Chain... at 100%
5ojeRCSB PDB    PDBbind330aa, >5OJE_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1fq6RCSB PDB    PDBbind0QF
Entry Information
PDB ID1epq
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameendothiapepsin
Ligand Name0QF
EC.Number E.C.3.4.23.22
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=6.5nM
Release Year1994
Protein/NA SequenceCheck fasta file
Primary Reference J.Med.Chem. v36 pp. 3809-20, 1993
Ligand Properties
Formula C27H46N3O6S2
Molecular Weight 572.801
Exact Mass 572.283
No. of atoms 84
No. of bonds 85
Polar Surface Area 201.75
LOGP Value 4.67      (Computed with XLOGP3)
4.91      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 19
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 2
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): P11838  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
This site has been visited times since Nov 2007.


Copyright ©2007-2024    涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃    缃戠珯澶囨鍙凤細娌狪CP澶2021015625鍙-3    娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓


Technical Support锛堟妧鏈敮鎸侊級: yingsaisi@foxmail.com