Browse entries in the PDBbind-CN Database

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Related entries of code: 4gq4
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4og3RCSB PDB    PDBbind480aa, >4OG3_1|Chain... at 100%
4og4RCSB PDB    PDBbind480aa, >4OG4_1|Chain... at 100%
4og5RCSB PDB    PDBbind480aa, >4OG5_1|Chain... at 100%
4og6RCSB PDB    PDBbind489aa, >4OG6_1|Chain... at 99%
4og7RCSB PDB    PDBbind489aa, >4OG7_1|Chain... at 99%
4og8RCSB PDB    PDBbind489aa, >4OG8_1|Chain... at 99%
4x5yRCSB PDB    PDBbind489aa, >4X5Y_1|Chain... at 100%
4x5zRCSB PDB    PDBbind489aa, >4X5Z_1|Chain... at 100%
5db0RCSB PDB    PDBbind489aa, >5DB0_1|Chain... at 100%
5db1RCSB PDB    PDBbind489aa, >5DB1_1|Chain... at 100%
5db2RCSB PDB    PDBbind489aa, >5DB2_1|Chain... at 100%
5db3RCSB PDB    PDBbind489aa, >5DB3_1|Chain... at 100%
5dd9RCSB PDB    PDBbind489aa, >5DD9_1|Chain... at 100%
5ddaRCSB PDB    PDBbind489aa, >5DDA_1|Chain... at 100%
5ddbRCSB PDB    PDBbind489aa, >5DDB_1|Chain... at 100%
5ddcRCSB PDB    PDBbind489aa, >5DDC_1|Chain... at 100%
5dddRCSB PDB    PDBbind489aa, >5DDD_1|Chain... at 100%
5ddeRCSB PDB    PDBbind489aa, >5DDE_1|Chain... at 100%
5ddfRCSB PDB    PDBbind489aa, >5DDF_1|Chain... at 100%
6by8RCSB PDB    PDBbind489aa, >6BY8_1|Chain... at 99%
6bxyRCSB PDB    PDBbind489aa, >6BXY_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID4gq4
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameMenin (A541T mutation)
Ligand Name0RT
EC.Number E.C.-.-.-.-
Resolution 1.27(Å)
Affinity (Kd/Ki/IC50)Kd=22nM
Release Year2012
Protein/NA SequenceCheck fasta file
Primary Reference (2012) Blood Vol. 120: pp. 4461-4469
Ligand Properties
Formula C17H21F3N5S2
Molecular Weight 416.507
Exact Mass 416.119
No. of atoms 48
No. of bonds 51
Polar Surface Area 106.95
LOGP Value 3.60      (Computed with XLOGP3)
3.45      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
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): O00255  
Entrez Gene IDNCBI Entrez Gene ID: 4221  
ASDInformation of known allosteric effects of PDB entries

 
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