Browse entries in the PDBbind-CN Database

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Related entries of code: 3wzu
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
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%
6ib0RCSB PDB    PDBbind318aa, >6IB0_1|Chain... at 96%
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
3w55RCSB PDB    PDBbind1FM
4gs6RCSB PDB    PDBbind1FM
Entry Information
PDB ID3wzu
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameDual specificity mitogen-activated protein kinase kinase 7, MAP2K7
Ligand Name1FM
EC.Number E.C.2.7.12.2
Resolution 3.01(Å)
Affinity (Kd/Ki/IC50)IC50=1.3uM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Bioorg.Med.Chem.Lett.vol(25),593-596
Ligand Properties
Formula C19H24O7
Molecular Weight 364.390
Exact Mass 364.152
No. of atoms 50
No. of bonds 51
Polar Surface Area 113.29
LOGP Value 2.42      (Computed with XLOGP3)
1.82      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
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): O14733  
Entrez Gene IDNCBI Entrez Gene ID: 5609  
ASDInformation of known allosteric effects of PDB entries
 
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