Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

1T3Q

Crystal structure of quinoline 2-Oxidoreductase from Pseudomonas Putida 86

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0016491	molecular_function	oxidoreductase activity
A	0046872	molecular_function	metal ion binding
A	0051536	molecular_function	iron-sulfur cluster binding
A	0051537	molecular_function	2 iron, 2 sulfur cluster binding
B	0005506	molecular_function	iron ion binding
B	0016491	molecular_function	oxidoreductase activity
C	0000166	molecular_function	nucleotide binding
C	0016491	molecular_function	oxidoreductase activity
C	0050660	molecular_function	flavin adenine dinucleotide binding
C	0071949	molecular_function	FAD binding
D	0016491	molecular_function	oxidoreductase activity
D	0046872	molecular_function	metal ion binding
D	0051536	molecular_function	iron-sulfur cluster binding
D	0051537	molecular_function	2 iron, 2 sulfur cluster binding
E	0005506	molecular_function	iron ion binding
E	0016491	molecular_function	oxidoreductase activity
F	0000166	molecular_function	nucleotide binding
F	0016491	molecular_function	oxidoreductase activity
F	0050660	molecular_function	flavin adenine dinucleotide binding
F	0071949	molecular_function	FAD binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 B 3100

Chain	Residue
B	SER17
B	PRO672
B	MET673
B	GLU676
B	HOH5352
B	HOH5414

site_id	AC2
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 B 3101

Chain	Residue
B	ARG168
B	ARG318

site_id	AC3
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 B 3102

Chain	Residue
B	ARG168
B	HOH5210
B	HOH5425
B	VAL165

site_id	AC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 E 3103

Chain	Residue
E	PRO102
E	ARG110
E	HOH5109
E	HOH5114
E	HOH5423

site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 E 3104

Chain	Residue
E	ARG168
E	ARG318
E	ILE358

site_id	AC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 B 3105

Chain	Residue
A	HOH5021
B	PRO102
B	ASN106
B	ARG110
B	HOH5242
B	HOH5397

site_id	AC7
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 E 3106

Chain	Residue
E	ARG21
E	HOH5360

site_id	AC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 E 3107

Chain	Residue
E	PRO525
E	ALA526
E	SER527
E	HOH5039
E	HOH5129
E	HOH5503
E	HOH5680

site_id	AC9
Number of Residues	8
Details	BINDING SITE FOR RESIDUE FES A 4907

Chain	Residue
A	GLN106
A	CYS107
A	GLY108
A	CYS110
A	CYS142
A	ARG143
A	CYS144
B	MET201

site_id	BC1
Number of Residues	10
Details	BINDING SITE FOR RESIDUE FES A 4908

Chain	Residue
A	GLY47
A	CYS48
A	GLU49
A	GLY51
A	VAL52
A	CYS53
A	GLY54
A	CYS56
A	ARG66
A	CYS68

site_id	BC2
Number of Residues	8
Details	BINDING SITE FOR RESIDUE FES D 4909

Chain	Residue
D	GLN106
D	CYS107
D	GLY108
D	CYS110
D	CYS142
D	ARG143
D	CYS144
E	MET201

site_id	BC3
Number of Residues	10
Details	BINDING SITE FOR RESIDUE FES D 4910

Chain	Residue
D	GLY47
D	CYS48
D	GLU49
D	GLY51
D	VAL52
D	CYS53
D	GLY54
D	SER55
D	CYS56
D	CYS68

site_id	BC4
Number of Residues	33
Details	BINDING SITE FOR RESIDUE FAD C 4931

Chain	Residue
C	HOH4937
C	HOH4940
C	HOH4981
C	HOH5127
C	HOH5188
A	GLN50
A	GLY51
A	LEU69
C	ILE29
C	ALA31
C	GLY32
C	GLY33
C	GLN34
C	SER35
C	LEU36
C	LEU53
C	ALA73
C	HIS77
C	ALA101
C	GLY109
C	THR110
C	GLY113
C	SER114
C	ALA116
C	HIS117
C	ALA122
C	GLU123
C	LEU160
C	LEU166
C	GLY188
C	TYR190
C	HOH4932
C	HOH4935

site_id	BC5
Number of Residues	35
Details	BINDING SITE FOR RESIDUE FAD F 4932

Chain	Residue
D	GLN50
D	GLY51
D	VAL52
D	LEU69
F	ILE29
F	ALA31
F	GLY32
F	GLY33
F	GLN34
F	SER35
F	LEU36
F	LEU53
F	ALA73
F	HIS77
F	ALA101
F	GLY109
F	THR110
F	GLY113
F	SER114
F	ALA116
F	HIS117
F	ALA122
F	GLU123
F	LEU160
F	LEU166
F	GLY188
F	TYR190
F	HOH4934
F	HOH4938
F	HOH4940
F	HOH4948
F	HOH4995
F	HOH5006
F	HOH5010
F	HOH5214

site_id	BC6
Number of Residues	30
Details	BINDING SITE FOR RESIDUE MCN E 4920

Chain	Residue
D	GLN106
D	CYS144
E	GLY254
E	PHE255
E	GLY256
E	ARG371
E	SER506
E	GLY507
E	GLN508
E	HIS510
E	THR513
E	TYR545
E	ALA546
E	SER547
E	ARG548
E	GLY549
E	ALA550
E	CYS666
E	THR668
E	ILE670
E	ASN671
E	VAL675
E	GLN678
E	LYS739
E	GLY740
E	MET741
E	GLY742
E	SMO4922
E	HOH4928
E	HOH5061

site_id	BC7
Number of Residues	32
Details	BINDING SITE FOR RESIDUE MCN B 4921

Chain	Residue
A	GLN106
A	CYS144
B	GLY253
B	GLY254
B	PHE255
B	GLY256
B	ARG371
B	SER506
B	GLY507
B	GLN508
B	HIS510
B	THR513
B	TYR545
B	ALA546
B	SER547
B	ARG548
B	GLY549
B	ALA550
B	CYS666
B	THR668
B	ILE670
B	ASN671
B	ILE674
B	VAL675
B	GLN678
B	LYS739
B	GLY740
B	MET741
B	GLY742
B	SMO4923
B	HOH4945
B	HOH5040

site_id	BC8
Number of Residues	9
Details	BINDING SITE FOR RESIDUE SMO E 4922

Chain	Residue
E	GLN224
E	GLY256
E	TYR370
E	ARG371
E	TYR545
E	ALA546
E	GLU743
E	MCN4920
E	HOH5252

site_id	BC9
Number of Residues	10
Details	BINDING SITE FOR RESIDUE SMO B 4923

Chain	Residue
B	GLN224
B	PHE255
B	GLY256
B	TYR370
B	ARG371
B	TYR545
B	ALA546
B	GLU743
B	GOL3902
B	MCN4921

site_id	CC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE GOL E 3901

Chain	Residue
B	TRP220
B	ARG247
E	ARG247

site_id	CC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL B 3902

Chain	Residue
B	ALA369
B	VAL373
B	PHE375
B	ALA546
B	GLU743
B	SMO4923

site_id	CC3
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL F 3903

Chain	Residue
D	ALA63
D	PRO64
D	SER120
F	PHE78
F	GLN103
F	ASN107
F	HOH5079
F	HOH5120

site_id	CC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE GOL E 3904

Chain	Residue
D	HOH4934
E	LEU708
E	TYR711
E	LEU712
E	ILE713
F	ARG186

site_id	CC5
Number of Residues	8
Details	BINDING SITE FOR RESIDUE GOL E 3905

Chain	Residue
E	LEU692
E	ILE696
E	HOH5000
E	HOH5347
F	ARG185
F	ILE257
F	HIS258
F	HOH4993

site_id	CC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE GOL B 3906

Chain	Residue
B	ARG567
B	GLN570
B	ASP621
B	HOH4970
B	HOH5141

site_id	CC7
Number of Residues	9
Details	BINDING SITE FOR RESIDUE GOL C 3907

Chain	Residue
A	MET65
C	GLY32
C	ASN107
C	ARG108
C	THR110
C	HOH4941
C	HOH4946
C	HOH4992
C	HOH5149

site_id	CC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE GOL C 3908

Chain	Residue
C	VAL143
C	ARG168

site_id	CC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE GOL A 3909

Chain	Residue
A	SER129
A	ARG130
A	HOH4923
A	HOH4999

Functional Information from PROSITE/UniProt

site_id	PS00197
Number of Residues	9
Details	2FE2S_FER_1 2Fe-2S ferredoxin-type iron-sulfur binding region signature. CEQGVCGSC

Chain	Residue	Details
A	CYS48-CYS56

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