Browse entries in the PDBbind-CN Database

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Related entries of code: 6h37
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3mdzRCSB PDB    PDBbind281aa, >3MDZ_1|Chain... *
3ml5RCSB PDB    PDBbind269aa, >3ML5_1|Chain... at 95%
6h36RCSB PDB    PDBbind274aa, >6H36_1|Chain... at 93%
6h38RCSB PDB    PDBbind274aa, >6H38_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
6h33RCSB PDB    PDBbindFKQ

Entry Information
PDB ID6h37
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namecarbonic anhydrase VII
Ligand NameFKQ
EC.Number E.C.-.-.-.-
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=2.6nM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Eur J Med Chem Vol. 163: pp. 443-452
Ligand Properties
Formula C18H20N2O4S
Molecular Weight 360.427
Exact Mass 360.114
No. of atoms 45
No. of bonds 47
Polar Surface Area 109.08
LOGP Value 1.10      (Computed with XLOGP3)
3.18      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
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): P43166  
Entrez Gene IDNCBI Entrez Gene ID: 766  
ASDInformation of known allosteric effects of PDB entries

 
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