Browse entries in the PDBbind-CN Database

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Related entries of code: 2jbp
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2jboRCSB PDB    PDBbind326aa, >2JBO_1|Chain... at 99%
2p3gRCSB PDB    PDBbind327aa, >2P3G_1|Chain... at 100%
2pzyRCSB PDB    PDBbind324aa, >2PZY_1|Chains... at 100%
3a2cRCSB PDB    PDBbind324aa, >3A2C_1|Chains... at 100%
3fpmRCSB PDB    PDBbind325aa, >3FPM_1|Chain... at 99%
3fyjRCSB PDB    PDBbind327aa, >3FYJ_1|Chain... at 100%
3fykRCSB PDB    PDBbind327aa, >3FYK_1|Chain... at 100%
3kc3RCSB PDB    PDBbind324aa, >3KC3_1|Chains... at 100%
3r2bRCSB PDB    PDBbind318aa, >3R2B_1|Chains... at 100%
3r2yRCSB PDB    PDBbind319aa, >3R2Y_1|Chain... at 100%
3wi6RCSB PDB    PDBbind324aa, >3WI6_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
2jboRCSB PDB    PDBbindP4O
3fhrRCSB PDB    PDBbindP4O
3r2yRCSB PDB    PDBbindP4O

Entry Information
PDB ID2jbp
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Ligand NameP4O
EC.Number E.C.
Resolution 3.31(Å)
Affinity (Kd/Ki/IC50)IC50=8.5nM
Release Year2007
Protein/NA SequenceCheck fasta file
Primary Reference J. Mol. Biol. 2007, 369, 735-745.
Ligand Properties
Formula C21H16N4O
Molecular Weight 340.378
Exact Mass 340.132
No. of atoms 42
No. of bonds 46
Polar Surface Area 70.67
LOGP Value 2.58      (Computed with XLOGP3)
3.91      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
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): P49137  
Entrez Gene IDNCBI Entrez Gene ID: 9261  
ASDInformation of known allosteric effects of PDB entries

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