3KOQ

Crystal structure of a nitroreductase family protein (cd3355) from clostridium difficile 630 at 1.58 A resolution

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000166	molecular_function	nucleotide binding
A	0009401	biological_process	phosphoenolpyruvate-dependent sugar phosphotransferase system
A	0016020	cellular_component	membrane
A	0016491	molecular_function	oxidoreductase activity
B	0000166	molecular_function	nucleotide binding
B	0009401	biological_process	phosphoenolpyruvate-dependent sugar phosphotransferase system
B	0016020	cellular_component	membrane
B	0016491	molecular_function	oxidoreductase activity
C	0000166	molecular_function	nucleotide binding
C	0009401	biological_process	phosphoenolpyruvate-dependent sugar phosphotransferase system
C	0016020	cellular_component	membrane
C	0016491	molecular_function	oxidoreductase activity
D	0000166	molecular_function	nucleotide binding
D	0009401	biological_process	phosphoenolpyruvate-dependent sugar phosphotransferase system
D	0016020	cellular_component	membrane
D	0016491	molecular_function	oxidoreductase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	26
Details	BINDING SITE FOR RESIDUE FMN A 300

Chain	Residue
A	ARG10
A	TYR119
A	ARG155
A	ARG160
A	HOH242
A	HOH330
A	HOH490
A	HOH636
B	PRO37
B	THR38
B	GLY39
A	TYR11
B	ASN41
B	ILE94
B	ASP95
B	ILE98
B	CL173
C	LYS148
C	HOH284
A	SER12
A	ARG14
A	TYR66
A	VAL115
A	TRP116
A	VAL117
A	CYS118

---

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL A 173

Chain	Residue
A	LYS9
A	PRO150
A	HOH653
A	HOH680
A	HOH708

---

site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL A 174

Chain	Residue
A	GLY40
A	TRP82
A	HOH881
B	GOL176
B	FMN300

---

site_id	AC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL A 175

Chain	Residue
A	ILE149
A	PRO150
A	GLU151

---

site_id	AC5
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL A 176

Chain	Residue
A	MSE1
A	ASN2
A	PHE3
A	GLU109
B	MSE1
B	PHE3
B	LEU6
B	GLU109

---

site_id	AC6
Number of Residues	24
Details	BINDING SITE FOR RESIDUE FMN B 300

Chain	Residue
A	PRO37
A	THR38
A	GLY39
A	ASN41
A	ILE94
A	ASP95
A	ILE98
A	GOL174
B	ARG10
B	TYR11
B	SER12
B	ARG14
B	TYR66
B	VAL115
B	TRP116
B	VAL117
B	CYS118
B	TYR119
B	ARG155
B	ARG160
B	GOL176
B	HOH197
B	HOH233
B	HOH247

---

site_id	AC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL B 173

Chain	Residue
A	FMN300
B	GLY40
C	ILE149

---

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE CL B 174

Chain	Residue
B	ILE149
B	HOH779
C	GLY40
D	FMN300

---

site_id	AC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 175

Chain	Residue
A	PHE86
B	ALA62
B	ASN64
B	TYR119
B	HOH195
B	HOH229

---

site_id	BC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 176

Chain	Residue
A	GOL174
A	HOH881
B	ARG14
B	FMN300
B	HOH716
B	HOH789

---

site_id	BC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 177

Chain	Residue
A	TYR119
A	HOH434
A	HOH577
B	ARG84
B	PRO85
B	PHE86

---

site_id	BC3
Number of Residues	22
Details	BINDING SITE FOR RESIDUE FMN C 300

Chain	Residue
C	ARG14
C	TYR66
C	VAL115
C	TRP116
C	VAL117
C	CYS118
C	TYR119
C	ARG155
C	ARG160
C	HOH264
C	HOH336
C	HOH709
D	PRO37
D	THR38
D	GLY39
D	ASN41
D	ILE94
D	ILE98
D	GOL175
C	ARG10
C	TYR11
C	SER12

---

site_id	BC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL C 173

Chain	Residue
C	ALA62
C	ASN64
C	TYR119
C	HOH311
C	HOH769
D	PHE86

---

site_id	BC5
Number of Residues	10
Details	BINDING SITE FOR RESIDUE GOL C 174

Chain	Residue
C	LYS9
C	THR108
C	GLY111
C	LEU112
C	ALA113
C	GLU146
C	PRO150
C	HOH237
C	HOH371
C	HOH414

---

site_id	BC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL C 175

Chain	Residue
C	LYS158
C	THR159
C	ARG160
C	VAL161
D	ASN41
D	GLN43

---

site_id	BC7
Number of Residues	26
Details	BINDING SITE FOR RESIDUE FMN D 300

Chain	Residue
B	LYS148
B	CL174
C	PRO37
C	THR38
C	GLY39
C	ASN41
C	LEU91
C	ILE94
C	ILE98
D	ARG10
D	TYR11
D	SER12
D	ARG14
D	TYR66
D	VAL115
D	TRP116
D	VAL117
D	CYS118
D	TYR119
D	ARG155
D	ARG160
D	HOH241
D	HOH280
D	HOH356
D	HOH365
D	HOH654

---

site_id	BC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL D 173

Chain	Residue
D	LYS9
D	PRO150
D	HOH341
D	HOH580
D	HOH762

---

site_id	BC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL D 174

Chain	Residue
C	MSE1
C	GLU109
D	MSE1
D	ASN2
D	GLU109

---

site_id	CC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL D 175

Chain	Residue
C	TYR119
C	FMN300
D	GLY40
D	TRP82

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