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Related entries of code: 4trc
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
1jysRCSB PDB    PDBbindADE
1nliRCSB PDB    PDBbindADE
2p8nRCSB PDB    PDBbindADE
2pqjRCSB PDB    PDBbindADE
3kpvRCSB PDB    PDBbindADE

Entry Information
PDB ID4trc
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameSulfolobus solfataricus adenine phosphoribosyltransferase
Ligand NameADE
EC.Number E.C.2.4.2.-
Resolution 2.4(Å)
Affinity (Kd/Ki/IC50)Kd=30uM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Biochemistry Vol. 54: pp. 2323-2334
Ligand Properties
Formula C5H5N5
Molecular Weight 135.127
Exact Mass 135.054
No. of atoms 15
No. of bonds 16
Polar Surface Area 80.48
LOGP Value -0.25      (Computed with XLOGP3)
0.52      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
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): Q97W95  
Entrez Gene IDNCBI Entrez Gene ID: 44128067  
ASDInformation of known allosteric effects of PDB entries

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