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Related entries of code: 6clv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
5jq9RCSB PDB    PDBbind6MB
Entry Information
PDB ID6clv
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameDihydropteroate synthase F17L E208K double mutant
Ligand Name6MB
EC.Number E.C.2.5.1.15
Resolution 2.3(Å)
Affinity (Kd/Ki/IC50)Kd=13.3uM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Front Microbiol Vol. 9: pp. 1369-1369
Ligand Properties
Formula C18H19N8O4S
Molecular Weight 443.460
Exact Mass 443.125
No. of atoms 50
No. of bonds 53
Polar Surface Area 191.41
LOGP Value 1.51      (Computed with XLOGP3)
2.54      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 4
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): O05701  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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