Browse entries in the PDBbind-CN Database

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Related entries of code: 6g5u
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3czvRCSB PDB    PDBbind264aa, >3CZV_1|Chains... *
4hu1RCSB PDB    PDBbind263aa, >4HU1_1|Chains... at 99%
4knmRCSB PDB    PDBbind263aa, >4KNM_1|Chains... at 99%
4knnRCSB PDB    PDBbind263aa, >4KNN_1|Chains... at 99%
4qizRCSB PDB    PDBbind263aa, >4QIZ_1|Chains... at 99%
4qjpRCSB PDB    PDBbind263aa, >4QJP_1|Chains... at 99%
4qjxRCSB PDB    PDBbind263aa, >4QJX_1|Chain... at 99%
5e2nRCSB PDB    PDBbind263aa, >5E2N_1|Chains... at 99%
5llaRCSB PDB    PDBbind263aa, >5LLA_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
6g6tRCSB PDB    PDBbindENN
Entry Information
PDB ID6g5u
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameCarbonic anhydrase 13
Ligand NameENN
EC.Number E.C.4.2.1.1
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)Kd=395nM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Eur J Med Chem Vol. 156: pp. 61-78
Ligand Properties
Formula C11H14Cl2N2O3S
Molecular Weight 325.211
Exact Mass 324.010
No. of atoms 33
No. of bonds 33
Polar Surface Area 97.64
LOGP Value 2.27      (Computed with XLOGP3)
4.34      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 5
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): Q8N1Q1  
Entrez Gene IDNCBI Entrez Gene ID: 377677  
ASDInformation of known allosteric effects of PDB entries
 
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