Browse entries in the PDBbind-CN Database

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Related entries of code: 2o22
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2w3lRCSB PDB    PDBbind144aa, >2W3L_1|Chains... at 99%
4aq3RCSB PDB    PDBbind169aa, >4AQ3_1|Chains... at 90%
4iehRCSB PDB    PDBbind169aa, >4IEH_1|Chain... at 91%
4lvtRCSB PDB    PDBbind166aa, >4LVT_1|Chains... at 93%
4lxdRCSB PDB    PDBbind166aa, >4LXD_1|Chain... at 93%
4manRCSB PDB    PDBbind166aa, >4MAN_1|Chains... at 93%
6gl8RCSB PDB    PDBbind172aa, >6GL8_1|Chain... *
6o0pRCSB PDB    PDBbind166aa, >6O0P_1|Chain... at 92%
6o0oRCSB PDB    PDBbind166aa, >6O0O_1|Chains... at 92%
6o0mRCSB PDB    PDBbind166aa, >6O0M_1|Chain... at 92%
6o0kRCSB PDB    PDBbind166aa, >6O0K_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID2o22
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameApoptosis regulator Bcl-2
Ligand NameLIU
EC.Number E.C.-.-.-.-
Resolution NMR
Affinity (Kd/Ki/IC50)Ki=67nM
Release Year2007
Protein/NA SequenceCheck fasta file
Primary Reference J.Med.Chem. 50: 641-662
Ligand Properties
Formula C30H36N4O5S2
Molecular Weight 596.761
Exact Mass 596.213
No. of atoms 77
No. of bonds 80
Polar Surface Area 158.01
LOGP Value 7.32      (Computed with XLOGP3)
8.46      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 10
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): P10415  
Entrez Gene IDNCBI Entrez Gene ID: 596  
ASDInformation of known allosteric effects of PDB entries

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