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Related entries of code: 2b17
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1fv0RCSB PDB    PDBbind121aa, >1FV0_1|Chains... *
1jq8RCSB PDB    PDBbind121aa, >1JQ8_1|Chains... at 100%
1jq9RCSB PDB    PDBbind121aa, >1JQ9_1|Chains... at 100%
1kpmRCSB PDB    PDBbind121aa, >1KPM_1|Chains... at 100%
1q7aRCSB PDB    PDBbind121aa, >1Q7A_1|Chain... at 100%
1sv3RCSB PDB    PDBbind121aa, >1SV3_1|Chain... at 100%
2armRCSB PDB    PDBbind121aa, >2ARM_1|Chain... at 100%
3h1xRCSB PDB    PDBbind121aa, >3H1X_1|Chain... at 100%
4qemRCSB PDB    PDBbind121aa, >4QEM_1|Chain... at 100%
4qerRCSB PDB    PDBbind121aa, >4QER_1|Chain... at 100%
4qf7RCSB PDB    PDBbind121aa, >4QF7_1|Chain... at 100%
4qf8RCSB PDB    PDBbind121aa, >4QF8_1|Chain... at 100%
4qgdRCSB PDB    PDBbind121aa, >4QGD_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4xtaRCSB PDB    PDBbindDIF

Entry Information
PDB ID2b17
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namephospholipase a2 vrv-pl-viiia
Ligand NameDIF
EC.Number E.C.3.1.1.4
Resolution 2.71(Å)
Affinity (Kd/Ki/IC50)Ki=0.62uM
Release Year2005
Protein/NA SequenceCheck fasta file
Primary Reference ACTA CRYSTALLOGR.,SECT.Dv62;pp.410-416
Ligand Properties
Formula C14H11Cl2NO2
Molecular Weight 296.149
Exact Mass 295.017
No. of atoms 30
No. of bonds 31
Polar Surface Area 49.33
LOGP Value 5.63      (Computed with XLOGP3)
4.44      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
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
UniProtKB ACUniProt accession number (AC): P59071  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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