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Related entries of code: 6b22
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3fv7RCSB PDB    PDBbind244aa, >3FV7_1|Chain... at 100%
3fyzRCSB PDB    PDBbind244aa, >3FYZ_1|Chain... at 100%
3fzcRCSB PDB    PDBbind244aa, >3FZC_1|Chain... at 100%
3mbzRCSB PDB    PDBbind244aa, >3MBZ_1|Chain... at 100%
4wm9RCSB PDB    PDBbind245aa, >4WM9_1|Chain... *
5tg4RCSB PDB    PDBbind245aa, >5TG4_1|Chain... at 98%
5tg5RCSB PDB    PDBbind245aa, >5TG5_1|Chain... at 99%
5tg6RCSB PDB    PDBbind245aa, >5TG6_1|Chain... at 99%
5tg7RCSB PDB    PDBbind245aa, >5TG7_1|Chain... at 99%
5vfdRCSB PDB    PDBbind244aa, >5VFD_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
6b1fRCSB PDB    PDBbindC8Y
6b1hRCSB PDB    PDBbindC8Y

Entry Information
PDB ID6b22
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameBeta-lactamase OXA-24/40
Ligand NameC8Y
EC.Number E.C.-.-.-.-
Resolution 1.93(Å)
Affinity (Kd/Ki/IC50)Kd=42nM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) J. Med. Chem. Vol. 61: pp. 4067-4086
Ligand Properties
Formula C7H14N3O5S
Molecular Weight 252.268
Exact Mass 252.065
No. of atoms 30
No. of bonds 30
Polar Surface Area 155.93
LOGP Value -3.39      (Computed with XLOGP3)
-0.29      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 1
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): Q8RLA6  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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