SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1n2o'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_B_AG2B7011_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 5 ARG A 188
LEU A 280
ASP A 281
LEU A 217
 None
 1.15A 1n13B-1n2oA:
0.0
1n13C-1n2oA:
0.0		 1n13B-1n2oA:
15.33
1n13C-1n2oA:
8.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 11 HIS A  44
GLY A  46
HIS A  47
ASP A 161
VAL A 187
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 0.79A 1pg2A-1n2oA:
5.6		 1pg2A-1n2oA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 11 HIS A  44
HIS A  47
GLY A 158
ASP A 161
VAL A 187
 SO4  A 601 (-3.9A)
SO4  A 601 ( 4.9A)
None
None
None
 1.09A 1pg2A-1n2oA:
5.6		 1pg2A-1n2oA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
GLY A  46
HIS A  47
ASP A 161
VAL A 187
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.03A 1qu2A-1n2oA:
undetectable		 1qu2A-1n2oA:
15.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QU2_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
GLY A  46
HIS A  47
GLY A 158
VAL A 187
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 0.78A 1qu2A-1n2oA:
undetectable		 1qu2A-1n2oA:
15.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QU3_A_MRCA993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
GLY A  46
HIS A  47
ASP A 161
VAL A 187
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.02A 1qu3A-1n2oA:
undetectable		 1qu3A-1n2oA:
15.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RK3_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  36
VAL A  37
SER A  65
VAL A 181
LEU A 165
 None
None
BAL  A 802 ( 4.9A)
None
None
 1.30A 1rk3A-1n2oA:
0.0		 1rk3A-1n2oA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S14_A_NOVA1300_1
(TOPOISOMERASE IV
SUBUNIT B)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 SER A  15
ASP A  19
PRO A 111
ASP A 112
THR A 105
 None
 1.47A 1s14A-1n2oA:
undetectable		 1s14A-1n2oA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1U1J_A_C2FA773_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 8 LYS A  83
ASN A 199
HIS A  44
SER A 197
 None
None
SO4  A 601 (-3.9A)
SO4  A 601 (-3.0A)
 1.15A 1u1jA-1n2oA:
2.2		 1u1jA-1n2oA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 11 HIS A  44
GLY A  46
HIS A  47
GLY A 158
ASP A 161
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.06A 2x1lA-1n2oA:
6.7		 2x1lA-1n2oA:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_B_ADNB601_1
(METHIONYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
GLY A  46
HIS A  47
GLY A 158
ASP A 161
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.00A 2x1lB-1n2oA:
6.8		 2x1lB-1n2oA:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 11 HIS A  44
GLY A  46
HIS A  47
GLY A 158
ASP A 161
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.02A 2x1lC-1n2oA:
6.8		 2x1lC-1n2oA:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Z97_A_CAMA422_0
(CYTOCHROME P450-CAM)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A 140
VAL A 143
VAL A 181
VAL A 155
 None
 0.80A 2z97A-1n2oA:
undetectable		 2z97A-1n2oA:
24.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZUJ_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 8 LEU A 140
VAL A 143
VAL A 181
VAL A 155
 None
 0.87A 2zujA-1n2oA:
undetectable		 2zujA-1n2oA:
24.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NVC_A_SALA370_1
(GENTISATE
1,2-DIOXYGENASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 6 GLN A 164
HIS A  44
HIS A  47
ASP A 161
 BAL  A 802 ( 4.6A)
SO4  A 601 (-3.9A)
SO4  A 601 ( 4.9A)
None
 1.22A 3nvcA-1n2oA:
0.0		 3nvcA-1n2oA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NVC_A_SALA370_1
(GENTISATE
1,2-DIOXYGENASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 6 GLN A 164
HIS A  47
HIS A  44
ASP A 161
 BAL  A 802 ( 4.6A)
SO4  A 601 ( 4.9A)
SO4  A 601 (-3.9A)
None
 0.97A 3nvcA-1n2oA:
0.0		 3nvcA-1n2oA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UA5_B_06XB502_1
(CYTOCHROME P450 2B6)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 10 LEU A 140
LEU A 177
PRO A  38
PHE A 157
VAL A 142
 None
None
BAL  A 802 ( 4.9A)
None
BAL  A 802 (-4.7A)
 1.17A 3ua5B-1n2oA:
0.0		 3ua5B-1n2oA:
21.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3UY4_A_PAUA302_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		6 / 8 HIS A 135
VAL A 139
VAL A 142
ASP A 161
GLN A 164
ARG A 198
 None
BAL  A 802 ( 4.7A)
BAL  A 802 (-4.7A)
None
BAL  A 802 ( 4.6A)
SO4  A 601 (-2.9A)
 0.85A 3uy4A-1n2oA:
34.2		 3uy4A-1n2oA:
36.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VT3_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  36
VAL A  37
SER A  65
VAL A 181
LEU A 165
 None
None
BAL  A 802 ( 4.9A)
None
None
 1.29A 3vt3A-1n2oA:
0.0		 3vt3A-1n2oA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VT7_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  36
VAL A  37
SER A  65
VAL A 181
LEU A 165
 None
None
BAL  A 802 ( 4.9A)
None
None
 1.28A 3vt7A-1n2oA:
undetectable		 3vt7A-1n2oA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E5J_A_017A201_3
(PROTEASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 174
VAL A 118
LEU A 144
 None
 0.64A 5e5jB-1n2oA:
undetectable		 5e5jB-1n2oA:
16.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_A_SAMA301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		7 / 12 HIS A  44
GLY A  46
LEU A  50
VAL A 142
GLY A 158
ASP A 161
THR A 186
 SO4  A 601 (-3.9A)
None
None
BAL  A 802 (-4.7A)
None
None
None
 0.47A 5hg0A-1n2oA:
28.8		 5hg0A-1n2oA:
34.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_A_SAMA301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  50
VAL A  68
GLY A 158
ASP A 161
THR A 186
 None
 1.25A 5hg0A-1n2oA:
28.8		 5hg0A-1n2oA:
34.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_A_SAMA301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A  68
GLY A 158
LYS A 160
ASP A 161
THR A 186
 None
 1.15A 5hg0A-1n2oA:
28.8		 5hg0A-1n2oA:
34.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_B_SAMB301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		8 / 12 HIS A  44
GLY A  46
HIS A  47
LEU A  50
VAL A 142
GLY A 158
ASP A 161
THR A 186
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
BAL  A 802 (-4.7A)
None
None
None
 0.40A 5hg0B-1n2oA:
28.8		 5hg0B-1n2oA:
34.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_B_SAMB301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
GLY A  46
HIS A  47
VAL A 143
ASP A 161
 SO4  A 601 (-3.9A)
None
SO4  A 601 ( 4.9A)
None
None
 1.13A 5hg0B-1n2oA:
28.8		 5hg0B-1n2oA:
34.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HG0_B_SAMB301_0
(PANTOTHENATE
SYNTHETASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 HIS A  44
VAL A  68
GLY A 158
LYS A 160
ASP A 161
 SO4  A 601 (-3.9A)
None
None
None
None
 1.09A 5hg0B-1n2oA:
28.8		 5hg0B-1n2oA:
34.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MFX_A_ACTA701_0
(GENOME POLYPROTEIN)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		4 / 5 ARG A 132
THR A 134
HIS A 135
ALA A  75
 None
 1.33A 5mfxA-1n2oA:
undetectable		 5mfxA-1n2oA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EMU_B_SAMB301_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 1n2o PANTOTHENATE
SYNTHETASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 268
ILE A 285
GLY A 266
ILE A 255
ILE A 283
 None
 1.07A 6emuB-1n2oA:
2.2		 6emuB-1n2oA:
18.09