5A5Z

Approved Drugs Containing Thiols as Inhibitors of Metallo-beta- lactamases: Strategy To Combat Multidrug-Resistant Bacteria

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0008270	molecular_function	zinc ion binding
A	0008800	molecular_function	beta-lactamase activity
A	0016787	molecular_function	hydrolase activity
A	0017001	biological_process	antibiotic catabolic process
A	0042597	cellular_component	periplasmic space
A	0046677	biological_process	response to antibiotic
A	0046872	molecular_function	metal ion binding
C	0008270	molecular_function	zinc ion binding
C	0008800	molecular_function	beta-lactamase activity
C	0016787	molecular_function	hydrolase activity
C	0017001	biological_process	antibiotic catabolic process
C	0042597	cellular_component	periplasmic space
C	0046677	biological_process	response to antibiotic
C	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE ZN A 302

Chain	Residue
A	HIS120
A	HIS122
A	HIS189
A	ZN303

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site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN A 303

Chain	Residue
A	ASP124
A	CYS208
A	HIS250
A	ZN302
A	WJZ304

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site_id	AC3
Number of Residues	7
Details	BINDING SITE FOR RESIDUE WJZ A 304

Chain	Residue
A	VAL73
A	TRP93
A	ASP124
A	HIS189
A	ASN220
A	HIS250
A	ZN303

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site_id	AC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN C 302

Chain	Residue
C	HIS120
C	HIS122
C	HIS189
C	CYS208
C	ZN303

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site_id	AC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN C 303

Chain	Residue
C	ASP124
C	CYS208
C	HIS250
C	ZN302
C	WJZ304

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site_id	AC6
Number of Residues	9
Details	BINDING SITE FOR RESIDUE WJZ C 304

Chain	Residue
C	MET67
C	HIS189
C	CYS208
C	LYS211
C	LEU218
C	GLY219
C	ASN220
C	HIS250
C	ZN303

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	12
Details	BINDING: BINDING => ECO:0000269|PubMed:22713171, ECO:0000269|PubMed:25815530

Chain	Residue	Details
A	HIS120
C	HIS189
C	CYS208
C	HIS250
A	HIS122
A	ASP124
A	HIS189
A	CYS208
A	HIS250
C	HIS120
C	HIS122
C	ASP124

---

site_id	SWS_FT_FI2
Number of Residues	4
Details	BINDING: BINDING => ECO:0000269|PubMed:22713171

Chain	Residue	Details
A	LYS211
A	ASN220
C	LYS211
C	ASN220

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