Browse entries in the PDBbind-CN Database

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Related entries of code: 6mll
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
5eecRCSB PDB    PDBbind269aa, >5EEC_1|Chains... at 100%
6b1fRCSB PDB    PDBbind268aa, >6B1F_1|Chains... at 98%
6b1hRCSB PDB    PDBbind268aa, >6B1H_1|Chains... at 98%
6b1jRCSB PDB    PDBbind268aa, >6B1J_1|Chains... at 98%
6b1wRCSB PDB    PDBbind268aa, >6B1W_1|Chains... at 98%
6b1xRCSB PDB    PDBbind268aa, >6B1X_1|Chains... at 98%
6b1yRCSB PDB    PDBbind268aa, >6B1Y_1|Chains... at 98%
6qwbRCSB PDB    PDBbind290aa, >6QWB_1|Chain... at 99%
6qwaRCSB PDB    PDBbind290aa, >6QWA_1|Chain... at 99%
6qw9RCSB PDB    PDBbind290aa, >6QW9_1|Chain... at 100%
6mnpRCSB PDB    PDBbind290aa, >6MNP_1|Chain... at 100%
6meyRCSB PDB    PDBbind290aa, >6MEY_1|Chain... at 100%
6m7iRCSB PDB    PDBbind290aa, >6M7I_1|Chain... at 100%
6jn4RCSB PDB    PDBbind265aa, >6JN4_1|Chains... at 99%
6jn5RCSB PDB    PDBbind264aa, >6JN5_1|Chains... at 100%
6jn3RCSB PDB    PDBbind265aa, >6JN3_1|Chains... at 99%
6j8qRCSB PDB    PDBbind265aa, >6J8Q_1|Chains... at 99%
6d19RCSB PDB    PDBbind290aa, >6D19_1|Chain... at 100%
6d18RCSB PDB    PDBbind290aa, >6D18_1|Chain... at 100%
6d17RCSB PDB    PDBbind290aa, >6D17_1|Chain... at 100%
6d16RCSB PDB    PDBbind290aa, >6D16_1|Chain... at 100%
6d15RCSB PDB    PDBbind290aa, >6D15_1|Chain... *
5mgiRCSB PDB    PDBbind264aa, >5MGI_1|Chain... at 100%
5ll7RCSB PDB    PDBbind268aa, >5LL7_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
6mduRCSB PDB    PDBbindN1G
Entry Information
PDB ID6mll
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameCarbapenem-hydrolyzing beta-lactamase KPC
Ligand NameN1G
EC.Number E.C.3.5.2.6
Resolution 1.86(Å)
Affinity (Kd/Ki/IC50)Ki=239uM
Release Year2019
Protein/NA SequenceCheck fasta file
Primary Reference (2019) Acs Infect Dis. Vol. 5: pp. 1013-1021
Ligand Properties
Formula C17H13N7O
Molecular Weight 331.331
Exact Mass 331.118
No. of atoms 38
No. of bonds 41
Polar Surface Area 101.38
LOGP Value 2.61      (Computed with XLOGP3)
2.38      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
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): Q9F663  
Entrez Gene IDNCBI Entrez Gene ID: 56982589  
ASDInformation of known allosteric effects of PDB entries
 
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