6CAC

Crystal structure of NDM-1 metallo-beta-lactamase harboring an insertion of a Pro residue in L3 loop

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0008800	molecular_function	beta-lactamase activity
B	0008800	molecular_function	beta-lactamase activity
C	0008800	molecular_function	beta-lactamase activity
D	0008800	molecular_function	beta-lactamase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	binding site for residue ZN A 1001

Chain	Residue
A	HIS121
A	HIS123
A	HIS190
A	ASN221
A	CD1002
A	HOH1191

---

site_id	AC2
Number of Residues	6
Details	binding site for residue CD A 1002

Chain	Residue
A	ZN1001
A	HOH1101
A	HOH1191
A	ASP125
A	CYS209
A	HIS251

---

site_id	AC3
Number of Residues	6
Details	binding site for residue NI A 1003

Chain	Residue
A	HIS160
A	HOH1203
A	HOH1207
A	HOH1223
D	HIS160
D	HOH1220

---

site_id	AC4
Number of Residues	1
Details	binding site for residue NI A 1004

Chain	Residue
A	HIS262

---

site_id	AC5
Number of Residues	4
Details	binding site for residue CO A 1005

Chain	Residue
A	GLU153
A	ASP224
B	GLU228
B	HOH1276

---

site_id	AC6
Number of Residues	4
Details	binding site for residue CA A 1006

Chain	Residue
A	ASP96
A	ASP131
A	HOH1215
A	HOH1317

---

site_id	AC7
Number of Residues	5
Details	binding site for residue SO4 A 1007

Chain	Residue
A	LYS212
A	ALA216
A	LYS217
A	SER218
A	HOH1161

---

site_id	AC8
Number of Residues	6
Details	binding site for residue SO4 A 1008

Chain	Residue
A	HIS160
A	SER161
A	HOH1104
A	HOH1121
A	HOH1160
A	HOH1255

---

site_id	AC9
Number of Residues	6
Details	binding site for residue SO4 A 1009

Chain	Residue
A	PHE241
A	PRO242
A	LYS243
A	ALA244
A	HOH1143
A	HOH1257

---

site_id	AD1
Number of Residues	4
Details	binding site for residue ZN B 1001

Chain	Residue
B	HIS121
B	HIS123
B	HIS190
B	HOH1135

---

site_id	AD2
Number of Residues	5
Details	binding site for residue CD B 1002

Chain	Residue
B	ASP125
B	CYS209
B	HIS251
B	HOH1101
B	HOH1135

---

site_id	AD3
Number of Residues	5
Details	binding site for residue NI B 1003

Chain	Residue
B	HIS160
B	HOH1226
D	GLY37
D	HIS38
D	HOH1206

---

site_id	AD4
Number of Residues	4
Details	binding site for residue CO B 1004

Chain	Residue
A	GLU228
B	GLU153
B	ASP224
B	HOH1275

---

site_id	AD5
Number of Residues	5
Details	binding site for residue CA B 1005

Chain	Residue
B	ASP96
B	ASP131
B	HOH1131
B	HOH1244
B	HOH1296

---

site_id	AD6
Number of Residues	5
Details	binding site for residue SO4 B 1006

Chain	Residue
B	SER214
B	THR261
B	HIS262
B	ARG265
B	HOH1200

---

site_id	AD7
Number of Residues	7
Details	binding site for residue SO4 B 1007

Chain	Residue
B	PHE241
B	PRO242
B	LYS243
B	ALA244
B	HOH1130
B	HOH1184
B	HOH1207

---

site_id	AD8
Number of Residues	4
Details	binding site for residue ZN C 1001

Chain	Residue
C	HIS121
C	HIS123
C	HIS190
C	HOH1140

---

site_id	AD9
Number of Residues	5
Details	binding site for residue CD C 1002

Chain	Residue
C	ASP125
C	CYS209
C	HIS251
C	HOH1140
C	HOH1251

---

site_id	AE1
Number of Residues	5
Details	binding site for residue NI C 1003

Chain	Residue
A	GLY37
A	HIS38
A	HOH1235
A	HOH1238
C	HIS160

---

site_id	AE2
Number of Residues	4
Details	binding site for residue CO C 1004

Chain	Residue
C	GLU153
C	ASP224
C	HOH1270
D	GLU228

---

site_id	AE3
Number of Residues	5
Details	binding site for residue CA C 1005

Chain	Residue
C	HOH1209
C	HOH1246
C	HOH1272
C	ASP96
C	ASP131

---

site_id	AE4
Number of Residues	8
Details	binding site for residue SO4 C 1006

Chain	Residue
C	SER161
C	HOH1110
C	HOH1144
C	HOH1146
C	HOH1156
D	ALA165
D	ALA166
D	HOH1115

---

site_id	AE5
Number of Residues	7
Details	binding site for residue SO4 C 1007

Chain	Residue
C	ARG257
C	THR261
C	THR261
C	ARG265
C	HOH1104
C	HOH1148
C	HOH1151

---

site_id	AE6
Number of Residues	7
Details	binding site for residue SO4 C 1008

Chain	Residue
C	PHE241
C	PRO242
C	LYS243
C	ALA244
C	HOH1138
C	HOH1160
C	HOH1202

---

site_id	AE7
Number of Residues	5
Details	binding site for residue ZN D 1001

Chain	Residue
D	HIS121
D	HIS123
D	HIS190
D	CD1002
D	HOH1106

---

site_id	AE8
Number of Residues	6
Details	binding site for residue CD D 1002

Chain	Residue
D	ASP125
D	CYS209
D	HIS251
D	ZN1001
D	HOH1106
D	HOH1225

---

site_id	AE9
Number of Residues	5
Details	binding site for residue NI D 1003

Chain	Residue
C	GLY37
C	HIS38
C	MET39
C	HOH1249
D	HIS262

---

site_id	AF1
Number of Residues	4
Details	binding site for residue CO D 1004

Chain	Residue
C	GLU228
D	GLU153
D	ASP224
D	HOH1258

---

site_id	AF2
Number of Residues	3
Details	binding site for residue CA D 1005

Chain	Residue
D	ASP96
D	ASP131
D	HOH1215

---

site_id	AF3
Number of Residues	6
Details	binding site for residue SO4 D 1006

Chain	Residue
D	PHE241
D	PRO242
D	LYS243
D	ALA244
D	HOH1127
D	HOH1185

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	24
Details	Binding site: {"evidences":[{"source":"PubMed","id":"22713171","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"25815530","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PubMed","id":"22713171","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---