Browse entries in the PDBbind-CN Database

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Related entries of code: 1m51
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1nhxRCSB PDB    PDBbind625aa, >1NHX_1|Chain... at 100%
2gmvRCSB PDB    PDBbind625aa, >2GMV_1|Chains... at 100%
2rk7RCSB PDB    PDBbind624aa, >2RK7_1|Chains... at 90%
2rk8RCSB PDB    PDBbind624aa, >2RK8_1|Chains... at 90%
2rkaRCSB PDB    PDBbind624aa, >2RKA_1|Chains... at 90%
2rkdRCSB PDB    PDBbind624aa, >2RKD_1|Chain... at 90%
2rkeRCSB PDB    PDBbind624aa, >2RKE_1|Chain... at 90%
3moeRCSB PDB    PDBbind624aa, >3MOE_1|Chain... at 90%
3mofRCSB PDB    PDBbind624aa, >3MOF_1|Chains... at 90%
3mohRCSB PDB    PDBbind624aa, >3MOH_1|Chains... at 90%
6p5oRCSB PDB    PDBbind622aa, >6P5O_1|Chain... at 90%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1m51
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namephosphoenolpyruvate carboxykinase, cytosolic
Ligand NameTSX
EC.Number E.C.4.1.1.32
Resolution 2.25(Å)
Affinity (Kd/Ki/IC50)IC50=18.8uM
Release Year2003
Protein/NA SequenceCheck fasta file
Primary Reference Bioorg.Med.Chem.Lett. v13 pp. 3871-4, 2003
Ligand Properties
Formula C21H25N5O3
Molecular Weight 395.455
Exact Mass 395.196
No. of atoms 54
No. of bonds 56
Polar Surface Area 101.78
LOGP Value 2.64      (Computed with XLOGP3)
2.49      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 8
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): P35558  
Entrez Gene IDNCBI Entrez Gene ID: 5105  
ASDInformation of known allosteric effects of PDB entries

 
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