Browse entries in the PDBbind-CN Database

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Related entries of code: 6qz6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4oq5RCSB PDB    PDBbind163aa, >4OQ5_1|Chains... at 93%
5ku9RCSB PDB    PDBbind162aa, >5KU9_1|Chains... at 90%
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%
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
6qz7RCSB PDB    PDBbindJLE
6qz5RCSB PDB    PDBbindJLE
6qylRCSB PDB    PDBbindJLE
Entry Information
PDB ID6qz6
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameMcl-1
Ligand NameJLE
EC.Number E.C.-.-.-.-
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Kd=0.32uM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2019) J.Med.Chem. Vol. 62: pp. 6913-6924
Ligand Properties
Formula C25H22N4O2S
Molecular Weight 442.533
Exact Mass 442.146
No. of atoms 54
No. of bonds 58
Polar Surface Area 119.14
LOGP Value 6.93      (Computed with XLOGP3)
5.58      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 5
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): Q07820  
Entrez Gene IDNCBI Entrez Gene ID: 4170  
ASDInformation of known allosteric effects of PDB entries
 
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