Browse entries in the PDBbind-CN Database

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Related entries of code: 4c2v
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2vgoRCSB PDB    PDBbind44aa, >2VGO_2|Chains... at 100%
2vgpRCSB PDB    PDBbind43aa, >2VGP_2|Chains... at 100%
2vrxRCSB PDB    PDBbind43aa, >2VRX_2|Chains... at 100%
3ztxRCSB PDB    PDBbind44aa, >3ZTX_2|Chains... at 100%
5eykRCSB PDB    PDBbind59aa, >5EYK_2|Chains... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID4c2v
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameAurora B kinase and INNER CENTROMERE PROTEIN A
Ligand NameYJA
EC.Number E.C.2.7.11.1
Resolution 1.49(Å)
Affinity (Kd/Ki/IC50)Ki=1nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Acta Crystallogr.,Sect.F Vol. 70: pp. 294-298
Ligand Properties
Formula C26H31FN7O3
Molecular Weight 508.568
Exact Mass 508.247
No. of atoms 68
No. of bonds 71
Polar Surface Area 129.49
LOGP Value 3.00      (Computed with XLOGP3)
2.23      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 10
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): O13024  Q6DE08  
Entrez Gene IDNCBI Entrez Gene ID: 398105  398457  
ASDInformation of known allosteric effects of PDB entries

 
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