Browse entries in the PDBbind-CN Database

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Related entries of code: 4y94
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1b55RCSB PDB    PDBbind169aa, >1B55_1|Chains... at 98%
1bwnRCSB PDB    PDBbind169aa, >1BWN_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1bq3RCSB PDB    PDBbindIHP
1zshRCSB PDB    PDBbindIHP
2lhaRCSB PDB    PDBbindIHP
3eebRCSB PDB    PDBbindIHP
3fzyRCSB PDB    PDBbindIHP
5klpRCSB PDB    PDBbindIHP
5tv1RCSB PDB    PDBbindIHP
6b4hRCSB PDB    PDBbindIHP
6bu0RCSB PDB    PDBbindIHP
6cusRCSB PDB    PDBbindIHP
Entry Information
PDB ID4y94
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameNon-specific protein-tyrosine kinase
Ligand NameIHP
EC.Number E.C.2.7.10.2
Resolution 2.4(Å)
Affinity (Kd/Ki/IC50)Kd=238nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) eLlife Vol. 4: pp.1-31
Ligand Properties
Formula C6H24O24P6
Molecular Weight 666.083
Exact Mass 665.908
No. of atoms 60
No. of bonds 60
Polar Surface Area 501.06
LOGP Value -11.25      (Computed with XLOGP3)
-5.76      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 1
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): Q3ZC95  
Entrez Gene IDNCBI Entrez Gene ID: 533459  
ASDInformation of known allosteric effects of PDB entries
 
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