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Related entries of code: 4pzv
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
4f7vRCSB PDB    PDBbindJ1D
Entry Information
PDB ID4pzv
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Name2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase/dihydropteroate synthase HPPK-DHPS
Ligand NameJ1D
EC.Number E.C.2.5.1.15
Resolution 1.7(Å)
Affinity (Kd/Ki/IC50)Kd=2.0uM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Febs J. Vol. 281: pp. 4123-4137
Ligand Properties
Formula C23H30N12O8S
Molecular Weight 634.625
Exact Mass 634.203
No. of atoms 74
No. of bonds 78
Polar Surface Area 316.19
LOGP Value -4.64      (Computed with XLOGP3)
-1.08      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 20
No. of Rings: 5
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): Q5NGA7  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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