Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

3NN3

Structure of chlorite dismutase from Candidatus Nitrospira defluvii R173A mutant

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0016491	molecular_function	oxidoreductase activity
A	0020037	molecular_function	heme binding
A	0046872	molecular_function	metal ion binding
A	0050587	molecular_function	chlorite O2-lyase activity
B	0016491	molecular_function	oxidoreductase activity
B	0020037	molecular_function	heme binding
B	0046872	molecular_function	metal ion binding
B	0050587	molecular_function	chlorite O2-lyase activity
C	0016491	molecular_function	oxidoreductase activity
C	0020037	molecular_function	heme binding
C	0046872	molecular_function	metal ion binding
C	0050587	molecular_function	chlorite O2-lyase activity
D	0016491	molecular_function	oxidoreductase activity
D	0020037	molecular_function	heme binding
D	0046872	molecular_function	metal ion binding
D	0050587	molecular_function	chlorite O2-lyase activity
E	0016491	molecular_function	oxidoreductase activity
E	0020037	molecular_function	heme binding
E	0046872	molecular_function	metal ion binding
E	0050587	molecular_function	chlorite O2-lyase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	18
Details	BINDING SITE FOR RESIDUE HEM A 239

Chain	Residue
A	PRO108
A	ALA164
A	LEU168
A	PHE186
A	THR188
A	PHE190
A	LEU201
A	LEU205
A	SO4242
A	HOH245
A	THR109
A	TYR110
A	VAL111
A	ILE139
A	TRP145
A	MET157
A	HIS160
A	THR161

site_id	AC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 240

Chain	Residue
A	HIS199
A	ARG203
E	LYS106
E	HIS177
E	SO4240
E	HOH264

site_id	AC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 A 241

Chain	Residue
A	LYS106
A	HIS177
A	SO4242
C	HIS199
C	ARG203

site_id	AC4
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 A 242

Chain	Residue
A	TYR110
A	TRP145
A	TRP146
A	PHE186
A	HEM239
A	SO4241
C	ARG203

site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 243

Chain	Residue
A	HIS219
A	HOH266
E	LYS140
E	ARG215
E	ARG216
E	HOH245

site_id	AC6
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 A 244

Chain	Residue
A	ASP183
A	ARG216
C	HIS219

site_id	AC7
Number of Residues	16
Details	BINDING SITE FOR RESIDUE HEM B 239

Chain	Residue
B	PRO108
B	THR109
B	TYR110
B	VAL111
B	ILE139
B	TRP145
B	MET157
B	HIS160
B	THR161
B	ALA164
B	PHE186
B	PHE190
B	LEU205
B	SO4241
B	HOH247
B	HOH263

site_id	AC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 B 240

Chain	Residue
B	LYS106
B	HIS177
B	SO4241
D	HIS199
D	ARG203

site_id	AC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 B 241

Chain	Residue
B	THR109
B	TYR110
B	TRP146
B	HEM239
B	SO4240
B	HOH263
D	ARG203

site_id	BC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 B 242

Chain	Residue
B	ASP183
D	HIS219

site_id	BC2
Number of Residues	15
Details	BINDING SITE FOR RESIDUE HEM C 239

Chain	Residue
C	PRO108
C	THR109
C	TYR110
C	VAL111
C	TRP145
C	MET157
C	HIS160
C	THR161
C	ALA164
C	LEU168
C	PHE186
C	PHE190
C	LEU205
C	SO4241
C	HOH245

site_id	BC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 C 240

Chain	Residue
B	HIS199
B	ARG203
C	LYS106
C	HIS177
C	SO4241

site_id	BC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 C 241

Chain	Residue
C	SO4240
B	ARG203
C	THR109
C	TYR110
C	HEM239

site_id	BC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 C 242

Chain	Residue
B	HIS219
C	LYS140
C	ARG215
C	ARG216

site_id	BC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 C 243

Chain	Residue
A	LYS140
A	ARG215
A	HOH265
C	HIS219
C	HOH254

site_id	BC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 C 244

Chain	Residue
B	HIS219
C	ASP183
C	ARG216

site_id	BC8
Number of Residues	16
Details	BINDING SITE FOR RESIDUE HEM D 239

Chain	Residue
D	PRO108
D	THR109
D	TYR110
D	VAL111
D	ILE139
D	TRP145
D	MET157
D	HIS160
D	THR161
D	ALA164
D	LEU168
D	LEU175
D	PHE186
D	PHE190
D	LEU205
D	SO4241

site_id	BC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 D 240

Chain	Residue
D	LYS106
D	HIS177
D	SO4241
E	HIS199
E	ARG203

site_id	CC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 D 241

Chain	Residue
D	THR109
D	TYR110
D	PHE186
D	HEM239
D	SO4240
E	ARG203

site_id	CC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 D 242

Chain	Residue
D	ASP183
D	ARG216
E	HIS219

site_id	CC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 243

Chain	Residue
D	LYS140
D	ARG215
D	ARG216
E	HIS219

site_id	CC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 D 244

Chain	Residue
B	LYS140
B	ARG215
B	HOH254
D	HIS219
D	HOH252

site_id	CC5
Number of Residues	17
Details	BINDING SITE FOR RESIDUE HEM E 239

Chain	Residue
E	PRO108
E	THR109
E	TYR110
E	VAL111
E	LEU122
E	ILE139
E	LYS141
E	TRP145
E	MET157
E	HIS160
E	THR161
E	ALA164
E	PHE186
E	PHE190
E	LEU201
E	LEU205
E	SO4240

site_id	CC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 E 240

Chain	Residue
A	ARG203
A	SO4240
E	THR109
E	TYR110
E	HEM239

site_id	CC7
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 E 241

Chain	Residue
A	HIS219
E	ASP183
E	ARG216

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)