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: 3oui
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2g19RCSB PDB    PDBbind244aa, >2G19_1|Chain... at 97%
2y34RCSB PDB    PDBbind252aa, >2Y34_1|Chain... *
3ouhRCSB PDB    PDBbind237aa, >3OUH_1|Chain... at 100%
3oujRCSB PDB    PDBbind237aa, >3OUJ_1|Chain... at 100%
4bqwRCSB PDB    PDBbind252aa, >4BQW_1|Chain... at 100%
4bqxRCSB PDB    PDBbind252aa, >4BQX_1|Chain... at 100%
4bqyRCSB PDB    PDBbind252aa, >4BQY_1|Chain... at 100%
4jzrRCSB PDB    PDBbind216aa, >4JZR_1|Chain... at 97%
5a3uRCSB PDB    PDBbind252aa, >5A3U_1|Chains... at 100%
5ox5RCSB PDB    PDBbind252aa, >5OX5_1|Chain... at 100%
5ox6RCSB PDB    PDBbind252aa, >5OX6_1|Chain... at 100%
6st3RCSB PDB    PDBbind233aa, >6ST3_1|Chains... 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 ID3oui
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameEgl nine homolog 1,PHD2
Ligand Name42Z
EC.Number E.C.1.14.11.-
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)IC50=12.6uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) ACS MED.CHEM.LETT.
Ligand Properties
Formula C10H7Cl2N3O3
Molecular Weight 288.087
Exact Mass 286.986
No. of atoms 25
No. of bonds 26
Polar Surface Area 95.08
LOGP Value 2.83      (Computed with XLOGP3)
2.08      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 6
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): Q9GZT9  
Entrez Gene IDNCBI Entrez Gene ID: 54583  
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