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: 6ib0
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3wzuRCSB PDB    PDBbind324aa, >3WZU_1|Chain... *
6qhrRCSB PDB    PDBbind318aa, >6QHR_1|Chain... at 96%
6qhoRCSB PDB    PDBbind318aa, >6QHO_1|Chain... at 96%
6qg7RCSB PDB    PDBbind318aa, >6QG7_1|Chain... at 96%
6qg4RCSB PDB    PDBbind318aa, >6QG4_1|Chain... at 96%
6qftRCSB PDB    PDBbind318aa, >6QFT_1|Chain... at 96%
6ib2RCSB PDB    PDBbind318aa, >6IB2_1|Chain... at 95%
5z1eRCSB PDB    PDBbind324aa, >5Z1E_1|Chain... at 99%
5z1dRCSB PDB    PDBbind324aa, >5Z1D_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID6ib0
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameMKK7
Ligand NameH8Z
EC.Number E.C.-.-.-.-
Resolution 2.6(Å)
Affinity (Kd/Ki/IC50)IC50=40nM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2019) J.Med.Chem. Vol. 62: pp. 2843-2848
Ligand Properties
Formula C15H18N6O
Molecular Weight 298.343
Exact Mass 298.154
No. of atoms 40
No. of bonds 42
Polar Surface Area 89.93
LOGP Value 0.54      (Computed with XLOGP3)
1.48      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
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): O14733  
Entrez Gene IDNCBI Entrez Gene ID: 5609  
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