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Related entries of code: 1q1g
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1nw4RCSB PDB    PDBbind276aa, >1NW4_1|Chains... *
6aqsRCSB PDB    PDBbind246aa, >6AQS_1|Chain... at 98%
5zniRCSB PDB    PDBbind245aa, >5ZNI_1|Chain... at 99%
5zncRCSB PDB    PDBbind245aa, >5ZNC_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1q1g
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameuridine phosphorylase
Ligand NameMTI
EC.Number E.C.2.4.2.1
Resolution 2.02(Å)
Affinity (Kd/Ki/IC50)Kd=2.7nM
Release Year2004
Protein/NA SequenceCheck fasta file
Primary Reference J.Biol.Chem. v279 pp. 18103-6, 2004
Ligand Properties
Formula C12H17N4O3S
Molecular Weight 297.353
Exact Mass 297.102
No. of atoms 37
No. of bonds 39
Polar Surface Area 143.91
LOGP Value -1.51      (Computed with XLOGP3)
-0.11      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 7
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): Q8I3X4  
Entrez Gene IDNCBI Entrez Gene ID: 812947  
ASDInformation of known allosteric effects of PDB entries

 
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