Related entries of code: 3ao1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1hyvRCSB PDB    PDBbind166aa, >1hyv_A... at 92%
1hyzRCSB PDB    PDBbind166aa, >1hyz_A... at 92%
1qs4RCSB PDB    PDBbind154aa, >1qs4_C... at 94%
3ao2RCSB PDB    PDBbind163aa, >3ao2_B... at 96%
3ao4RCSB PDB    PDBbind163aa, >3ao4_B... at 96%
3ao5RCSB PDB    PDBbind163aa, >3ao5_B... at 96%
3lptRCSB PDB    PDBbind166aa, >3lpt_A... at 92%
3lpuRCSB PDB    PDBbind166aa, >3lpu_A... at 92%
3ovnRCSB PDB    PDBbind163aa, >3ovn_B... at 95%
4dmnRCSB PDB    PDBbind163aa, >4dmn_A... at 93%
4e1mRCSB PDB    PDBbind166aa, >4e1m_A... at 92%
4e1nRCSB PDB    PDBbind166aa, >4e1n_A... at 92%
4gvmRCSB PDB    PDBbind163aa, >4gvm_A... at 93%
4gw6RCSB PDB    PDBbind163aa, >4gw6_A... at 93%
4jlhRCSB PDB    PDBbind163aa, >4jlh_A... at 93%
4nyfRCSB PDB    PDBbind168aa, >4nyf_B... at 93%
4o0jRCSB PDB    PDBbind163aa, >4o0j_A... at 93%
4o55RCSB PDB    PDBbind163aa, >4o55_A... at 93%
4o5bRCSB PDB    PDBbind163aa, >4o5b_A... at 93%
4ojrRCSB PDB    PDBbind164aa, >4ojr_A... at 95%
4tsxRCSB PDB    PDBbind163aa, >4tsx_A... at 93%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID3ao1
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NamePOL polyprotein
Ligand NameBZX
EC.Number E.C.-.-.-.-
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Kd=5.5mM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference(2011) Chemmedchem Vol. 6: pp. 258-261
Ligand Properties
Formula C7H6O3
Molecular Weight 138.121
Exact Mass 138.032
No. of atoms 16
No. of bonds 17
Polar Surface Area 38.69
LOGP Value 1.23      (Computed with XLOGP3)
1.12      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
ASDInformation of known allosteric effects of PDB entries

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