Ligand
Ligand Name:   carbenicillin
Ligand Type:   non-polymer
Ligand ID:   COVPDB626 PubChem:   7059500
Synonym(s):  
  •   (r)-cbpc
  • zinc3871880
  • unii-g42zu72n5g component fppnzsszrutdap-njbdsqktsa-n
show 2 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](C(O)=O)c3ccccc3)C(=O)N2[C@H]1C(O)=O
Standard InChI:   InChI=1S/C17H18N2O6S/c1-17(2)11(16(24)25)19-13(21)10(14(19)26-17)18-12(20)9(15(22)23)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,18,20)(H,22,23)(H,24,25)/t9-,10-,11+,14-/m1/s1
Molecular Formula:   C17H18N2O6S Mol. Weight:   378.08856 logP:   0.4865
HBD:   3 HBA:   5
#Rotatable Bonds:   5 TPSA:   124.01

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
DD-transpeptidase Q8Y547 (Q8Y547_LISMO) Listeria monocytogenes serovar 1/2a (strain ATCC BAA-679 / EGD-e) 3ZGA CB9
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Beta-lactamase P9WKD3 (BLAC_MYCTU) Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) 3N8R CB9
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Peptidoglycan D,D-transpeptidase FtsI Q51504 (Q51504_PSEAI) Pseudomonas aeruginosa 3OCL CB9
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