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Related entries of code: 1li6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
184lRCSB PDB    PDBbind164aa, >184L_1|Chain... at 96%
185lRCSB PDB    PDBbind164aa, >185L_1|Chain... at 96%
186lRCSB PDB    PDBbind164aa, >186L_1|Chain... at 96%
187lRCSB PDB    PDBbind164aa, >187L_1|Chain... at 96%
188lRCSB PDB    PDBbind164aa, >188L_1|Chain... at 96%
1l83RCSB PDB    PDBbind164aa, >1L83_1|Chain... at 96%
1lgwRCSB PDB    PDBbind164aa, >1LGW_1|Chain... at 95%
1li2RCSB PDB    PDBbind164aa, >1LI2_1|Chain... at 95%
1li3RCSB PDB    PDBbind164aa, >1LI3_1|Chain... at 95%
220lRCSB PDB    PDBbind164aa, >220L_1|Chain... at 96%
223lRCSB PDB    PDBbind164aa, >223L_1|Chain... at 95%
3runRCSB PDB    PDBbind168aa, >3RUN_1|Chain... at 95%
4w52RCSB PDB    PDBbind172aa, >4W52_1|Chain... at 94%
4w53RCSB PDB    PDBbind172aa, >4W53_1|Chain... at 94%
4w54RCSB PDB    PDBbind172aa, >4W54_1|Chain... at 94%
4w55RCSB PDB    PDBbind172aa, >4W55_1|Chain... at 94%
4w57RCSB PDB    PDBbind172aa, >4W57_1|Chain... at 94%
6ajjRCSB PDB    PDBbind943aa, >6AJJ_1|Chain... at 100%
6ajiRCSB PDB    PDBbind943aa, >6AJI_1|Chain... at 100%
6ajhRCSB PDB    PDBbind943aa, >6AJH_1|Chain... at 100%
6ajgRCSB PDB    PDBbind943aa, >6AJG_1|Chain... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID1li6
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namelysozyme mutant l99a/m102q
Ligand Name5MP
EC.Number E.C.3.2.1.17
Resolution 2(Å)
Affinity (Kd/Ki/IC50)Kd=0.16mM
Release Year2002
Protein/NA SequenceCheck fasta file
Primary Reference J.Mol.Biol. v322 pp. 339-55, 2002
Ligand Properties
Formula C5H7N
Molecular Weight 81.116
Exact Mass 81.058
No. of atoms 13
No. of bonds 13
Polar Surface Area 15.79
LOGP Value 1.08      (Computed with XLOGP3)
1.32      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 1
No. of Rings: 1
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): P00720  
Entrez Gene IDNCBI Entrez Gene ID: 1258585  
ASDInformation of known allosteric effects of PDB entries
 
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