Browse entries in the PDBbind-CN Database

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Related entries of code: 5cte
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1uysRCSB PDB    PDBbind737aa, >1UYS_1|Chains... at 100%
1w2xRCSB PDB    PDBbind758aa, >1W2X_1|Chains... at 100%
3h0jRCSB PDB    PDBbind769aa, >3H0J_1|Chains... *
3h0qRCSB PDB    PDBbind769aa, >3H0Q_1|Chains... at 100%
3h0sRCSB PDB    PDBbind769aa, >3H0S_1|Chains... at 100%
3tv5RCSB PDB    PDBbind769aa, >3TV5_1|Chains... at 98%
3tvwRCSB PDB    PDBbind769aa, >3TVW_1|Chains... at 98%
4wyoRCSB PDB    PDBbind769aa, >4WYO_1|Chains... at 98%
4wz8RCSB PDB    PDBbind769aa, >4WZ8_1|Chains... at 98%
5ctbRCSB PDB    PDBbind769aa, >5CTB_1|Chains... at 98%
5ctcRCSB PDB    PDBbind769aa, >5CTC_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID5cte
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameHumanized yeast ACC carboxyltransferase domain
Ligand Name57L
EC.Number E.C.6.4.1.2
Resolution 2.34(Å)
Affinity (Kd/Ki/IC50)IC50=0.016uM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Bioorg.Med.Chem.Lett. Vol. 25: pp. 5352-5356
Ligand Properties
Formula C24H34N4O3
Molecular Weight 426.552
Exact Mass 426.263
No. of atoms 65
No. of bonds 68
Polar Surface Area 78.53
LOGP Value 4.17      (Computed with XLOGP3)
4.25      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
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): Q00955  
Entrez Gene IDNCBI Entrez Gene ID: 855750  
ASDInformation of known allosteric effects of PDB entries
 
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