Related entries of code: 3lir
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1jizRCSB PDB    PDBbind166aa, >1jiz_B... at 95%
1rmzRCSB PDB    PDBbind159aa, >1rmz_A... at 99%
1rosRCSB PDB    PDBbind163aa, >1ros_B... at 99%
1uttRCSB PDB    PDBbind159aa, >1utt_A... at 99%
1utzRCSB PDB    PDBbind159aa, >1utz_B... at 99%
1ycmRCSB PDB    PDBbind159aa, >1ycm_A... at 99%
1z3jRCSB PDB    PDBbind159aa, >1z3j_A... at 99%
2hu6RCSB PDB    PDBbind159aa, >2hu6_A... at 99%
2k2gRCSB PDB    PDBbind165aa, >2k2g_A... at 95%
2w0dRCSB PDB    PDBbind164aa, >2w0d_D... at 95%
2wo8RCSB PDB    PDBbind164aa, >2wo8_D... at 98%
2wo9RCSB PDB    PDBbind164aa, >2wo9_D... at 98%
2woaRCSB PDB    PDBbind164aa, >2woa_D... at 98%
3ehxRCSB PDB    PDBbind158aa, >3ehx_A... at 100%
3ehyRCSB PDB    PDBbind158aa, >3ehy_A... at 100%
3f15RCSB PDB    PDBbind158aa, >3f15_A... at 100%
3f16RCSB PDB    PDBbind158aa, >3f16_A... at 100%
3f17RCSB PDB    PDBbind158aa, >3f17_A... at 100%
3f18RCSB PDB    PDBbind158aa, >3f18_A... at 100%
3f19RCSB PDB    PDBbind158aa, >3f19_A... at 100%
3f1aRCSB PDB    PDBbind158aa, >3f1a_A... at 100%
3likRCSB PDB    PDBbind159aa, >3lik_A... at 99%
3lilRCSB PDB    PDBbind159aa, >3lil_A... at 99%
3ljgRCSB PDB    PDBbind159aa, >3ljg_A... at 99%
3lk8RCSB PDB    PDBbind158aa, >3lk8_A... at 100%
3lkaRCSB PDB    PDBbind158aa, >3lka_A... at 100%
3n2uRCSB PDB    PDBbind158aa, >3n2u_A... at 100%
3n2vRCSB PDB    PDBbind158aa, >3n2v_A... at 100%
3nx7RCSB PDB    PDBbind158aa, >3nx7_A... at 100%
3ts4RCSB PDB    PDBbind159aa, >3ts4_A... at 99%
3tskRCSB PDB    PDBbind159aa, >3tsk_A... at 99%
4efsRCSB PDB    PDBbind159aa, >4efs_A... at 99%
4gqlRCSB PDB    PDBbind159aa, >4gql_A... at 99%
4gr0RCSB PDB    PDBbind159aa, >4gr0_A... at 99%
4gr3RCSB PDB    PDBbind159aa, >4gr3_A... at 99%
4gr8RCSB PDB    PDBbind152aa, >4gr8_A... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID3lir
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameMacrophage metalloelastase, MMP12
Ligand NameEEC
EC.Number E.C.
Resolution 1.9(Å)
Affinity (Kd/Ki/IC50)Ki=119nM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference(2010) J.Biol.Chem. Vol. 285: pp. 35900-35909
Ligand Properties
Formula C22H24N4O8
Molecular Weight 472.4
LOGP Value 1.41      (Computed with XLOGP3)
Drug likenessNo. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 2

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
ASDInformation of known allosteric effects of PDB entries

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