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: 1s64
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1s63RCSB PDB    PDBbind778

Entry Information
PDB ID1s64
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namegeranylgeranyltransferase type-i
Ligand Name778
EC.Number E.C.2.5.1.59
Resolution 2.55(Å)
Affinity (Kd/Ki/IC50)Ki=4nM
Release Year2004
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry v43 pp. 9000-8, 2004
Ligand Properties
Formula C22H21ClN5O
Molecular Weight 406.888
Exact Mass 406.143
No. of atoms 50
No. of bonds 53
Polar Surface Area 66.36
LOGP Value 2.69      (Computed with XLOGP3)
3.52      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 4
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): P53610  Q04631  
Entrez Gene IDNCBI Entrez Gene ID: 81746  25318  
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