Browse entries in the PDBbind-CN Database

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Related entries of code: 3mv5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3cquRCSB PDB    PDBbind342aa, >3CQU_1|Chain... at 93%
3cqwRCSB PDB    PDBbind342aa, >3CQW_1|Chain... at 93%
3mvhRCSB PDB    PDBbind342aa, >3MVH_1|Chain... at 93%
3ocbRCSB PDB    PDBbind341aa, >3OCB_1|Chains... at 93%
3ow4RCSB PDB    PDBbind341aa, >3OW4_1|Chains... at 93%
3qkkRCSB PDB    PDBbind341aa, >3QKK_1|Chain... at 93%
3qklRCSB PDB    PDBbind341aa, >3QKL_1|Chain... at 93%
3qkmRCSB PDB    PDBbind341aa, >3QKM_1|Chain... at 93%
4gv1RCSB PDB    PDBbind340aa, >4GV1_1|Chain... at 94%
6buuRCSB PDB    PDBbind337aa, >6BUU_1|Chains... at 94%
6ccyRCSB PDB    PDBbind343aa, >6CCY_1|Chain... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3mvjRCSB PDB    PDBbindXFE

Entry Information
PDB ID3mv5
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namev-akt murine thymoma viral oncogene homolog 1 (AKT1)
Ligand NameXFE
EC.Number E.C.2.7.11.1
Resolution 2.47(Å)
Affinity (Kd/Ki/IC50)IC50=180nM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) J.Med.Chem. Vol. 53: pp. 4615-4622
Ligand Properties
Formula C11H16N5
Molecular Weight 218.278
Exact Mass 218.141
No. of atoms 32
No. of bonds 34
Polar Surface Area 72.45
LOGP Value 0.74      (Computed with XLOGP3)
0.15      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
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): P31749  P49841  
Entrez Gene IDNCBI Entrez Gene ID: 207  2932  
ASDInformation of known allosteric effects of PDB entries

 
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