Browse entries in the PDBbind-CN Database

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Related entries of code: 2xnp
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2xk3RCSB PDB    PDBbind279aa, >2XK3_1|Chain... *
2xk4RCSB PDB    PDBbind279aa, >2XK4_1|Chain... at 100%
2xk6RCSB PDB    PDBbind279aa, >2XK6_1|Chain... at 100%
2xk7RCSB PDB    PDBbind279aa, >2XK7_1|Chain... at 100%
2xk8RCSB PDB    PDBbind279aa, >2XK8_1|Chain... at 100%
2xkcRCSB PDB    PDBbind279aa, >2XKC_1|Chain... at 100%
2xkdRCSB PDB    PDBbind279aa, >2XKD_1|Chain... at 100%
2xkeRCSB PDB    PDBbind279aa, >2XKE_1|Chain... at 100%
2xkfRCSB PDB    PDBbind279aa, >2XKF_1|Chain... at 100%
2xnmRCSB PDB    PDBbind279aa, >2XNM_1|Chain... at 100%
2xnnRCSB PDB    PDBbind279aa, >2XNN_1|Chain... at 100%
2xnoRCSB PDB    PDBbind279aa, >2XNO_1|Chain... at 100%
4a4xRCSB PDB    PDBbind279aa, >4A4X_1|Chain... at 98%
4afeRCSB PDB    PDBbind279aa, >4AFE_1|Chain... at 100%
5m51RCSB PDB    PDBbind279aa, >5M51_1|Chain... at 100%
5m53RCSB PDB    PDBbind279aa, >5M53_1|Chain... at 99%
5m55RCSB PDB    PDBbind279aa, >5M55_1|Chain... at 100%
5m57RCSB PDB    PDBbind279aa, >5M57_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 ID2xnp
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Ligand NameWCX
EC.Number E.C.
Resolution 1.98(Å)
Affinity (Kd/Ki/IC50)IC50=0.36uM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) J.Med.Chem. Vol. 54: pp. 1626-1639
Ligand Properties
Formula C29H30F3N4O3
Molecular Weight 539.569
Exact Mass 539.227
No. of atoms 69
No. of bonds 73
Polar Surface Area 83.81
LOGP Value 5.29      (Computed with XLOGP3)
6.61      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
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): P51955  
Entrez Gene IDNCBI Entrez Gene ID: 4751  
ASDInformation of known allosteric effects of PDB entries

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