Ligand
Ligand Name:   (2S,5R,6R)-6-[(6S)-6-amino-6-carboxyhexanamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB907 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC1(C)S[C@@H]2[C@H](NC(=O)CCCC[C@H](N)C(O)=O)C(=O)N2[C@H]1C([O-])=O
Standard InChI:   InChI=1S/C15H23N3O6S/c1-15(2)10(14(23)24)18-11(20)9(12(18)25-15)17-8(19)6-4-3-5-7(16)13(21)22/h7,9-10,12H,3-6,16H2,1-2H3,(H,17,19)(H,21,22)(H,23,24)/p-1/t7-,9+,10-,12+/m0/s1
Molecular Formula:   C15H22N3O6S- Mol. Weight:   372.12347 logP:   -1.7443
HBD:   3 HBA:   7
#Rotatable Bonds:   8 TPSA:   152.86

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
D-alanyl-D-alanine carboxypeptidase DacA P0AEB2 (DACA_ECOLI) Escherichia coli (strain K12) 3BEB HJ3
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