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Related entries of code: 5ku9
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4oq5RCSB PDB    PDBbind163aa, >4OQ5_1|Chains... at 93%
5mesRCSB PDB    PDBbind162aa, >5MES_1|Chain... at 90%
5mevRCSB PDB    PDBbind162aa, >5MEV_1|Chain... at 90%
6fs0RCSB PDB    PDBbind159aa, >6FS0_1|Chain... at 90%
6qzbRCSB PDB    PDBbind170aa, >6QZB_1|Chain... at 91%
6qz8RCSB PDB    PDBbind170aa, >6QZ8_1|Chain... at 91%
6qz6RCSB PDB    PDBbind170aa, >6QZ6_1|Chain... at 91%
6qz5RCSB PDB    PDBbind170aa, >6QZ5_1|Chain... at 91%
6qypRCSB PDB    PDBbind170aa, >6QYP_1|Chain... at 91%
6qfqRCSB PDB    PDBbind170aa, >6QFQ_1|Chain... at 91%
6qb6RCSB PDB    PDBbind162aa, >6QB6_1|Chain... at 90%
6qb3RCSB PDB    PDBbind162aa, >6QB3_1|Chain... at 90%
6ovcRCSB PDB    PDBbind164aa, >6OVC_1|Chain... at 94%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID5ku9
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameInduced myeloid leukemia cell differentiation protein Mcl-1
Ligand Name6XJ
EC.Number E.C.-.-.-.-
Resolution 2.2(Å)
Affinity (Kd/Ki/IC50)IC50=1.49uM
Release Year2017
Protein/NA SequenceCheck fasta file
Primary Reference (2017) ACS Med Chem Lett Vol. 8: pp. 239-244
Ligand Properties
Formula C33H37BrCl2N5O4
Molecular Weight 718.488
Exact Mass 716.141
No. of atoms 82
No. of bonds 85
Polar Surface Area 135.25
LOGP Value 5.18      (Computed with XLOGP3)
4.86      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 15
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): P97287  Q07820  
Entrez Gene IDNCBI Entrez Gene ID: 17210  4170  
ASDInformation of known allosteric effects of PDB entries
 
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