Browse entries in the PDBbind-CN Database

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Related entries of code: 3mo2
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3fpdRCSB PDB    PDBbind261aa, >3FPD_1|Chains... at 100%
3mo0RCSB PDB    PDBbind285aa, >3MO0_1|Chains... at 100%
3mo5RCSB PDB    PDBbind285aa, >3MO5_1|Chains... at 100%
5ttgRCSB PDB    PDBbind287aa, >5TTG_1|Chains... *
5tuzRCSB PDB    PDBbind261aa, >5TUZ_1|Chains... at 100%
5vsdRCSB PDB    PDBbind261aa, >5VSD_1|Chains... at 100%
5vsfRCSB PDB    PDBbind261aa, >5VSF_1|Chains... at 100%
6mbpRCSB PDB    PDBbind261aa, >6MBP_1|Chains... at 100%
6mboRCSB PDB    PDBbind261aa, >6MBO_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3u78RCSB PDB    PDBbindE67

Entry Information
PDB ID3mo2
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameHistone-lysine N-methyltransferase, H3 lysine-9 specific 5(GLP)
Ligand NameE67
EC.Number E.C.2.1.1.43
Resolution 2.49(Å)
Affinity (Kd/Ki/IC50)Kd=244nM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) J.Mol.Biol. Vol. 400: pp. 1-7
Ligand Properties
Formula C31H50N7O2
Molecular Weight 552.774
Exact Mass 552.403
No. of atoms 90
No. of bonds 93
Polar Surface Area 104.82
LOGP Value 4.73      (Computed with XLOGP3)
2.75      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 9
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): Q9H9B1  
Entrez Gene IDNCBI Entrez Gene ID: 79813  
ASDInformation of known allosteric effects of PDB entries

 
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