SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3dtg'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2A1H_A_GBNA502_1
(BRANCHED CHAIN
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 8 TYR A 144
ARG A 146
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.33A 2a1hA-3dtgA:
44.4
2a1hB-3dtgA:
44.3		 2a1hA-3dtgA:
37.08
2a1hB-3dtgA:
37.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2A1H_B_GBNB501_1
(BRANCHED CHAIN
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 8 TYR A 144
ARG A 146
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.26A 2a1hA-3dtgA:
44.4
2a1hB-3dtgA:
44.3		 2a1hA-3dtgA:
37.08
2a1hB-3dtgA:
37.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2COI_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		7 / 10 TYR A 144
ARG A 146
TYR A 176
MET A 244
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
OBZ  A 371 (-3.4A)
None
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.49A 2coiA-3dtgA:
45.0
2coiB-3dtgA:
45.1		 2coiA-3dtgA:
37.53
2coiB-3dtgA:
37.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2COI_B_GBNB420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		7 / 10 TYR A 144
ARG A 146
TYR A 176
MET A 244
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
OBZ  A 371 (-3.4A)
None
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.49A 2coiA-3dtgA:
45.0
2coiB-3dtgA:
45.1		 2coiA-3dtgA:
37.53
2coiB-3dtgA:
37.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2COJ_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		8 / 11 PHE A  77
TYR A 144
ARG A 146
TYR A 176
MET A 244
GLY A 313
THR A 314
ALA A 315
 OBZ  A 371 (-4.6A)
None
OBZ  A 371 (-4.2A)
OBZ  A 371 (-3.4A)
None
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.30A 2cojA-3dtgA:
45.3
2cojB-3dtgA:
45.4		 2cojA-3dtgA:
37.53
2cojB-3dtgA:
37.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2COJ_B_GBNB420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		6 / 9 TYR A 144
ARG A 146
MET A 244
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
None
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.29A 2cojA-3dtgA:
45.3
2cojB-3dtgA:
45.4		 2cojA-3dtgA:
37.53
2cojB-3dtgA:
37.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		6 / 8 TYR A 144
ARG A 146
GLY A 243
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
PLP  A 369 ( 3.8A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.30A 2ej3A-3dtgA:
33.0		 2ej3A-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 8 TYR A 144
ARG A 146
THR A 314
ALA A 315
ALA A 316
 None
OBZ  A 371 (-4.2A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
None
 0.51A 2ej3A-3dtgA:
33.0		 2ej3A-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_B_GBNB914_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		7 / 10 PHE A  77
TYR A 144
ARG A 146
GLY A 243
GLY A 313
THR A 314
ALA A 315
 OBZ  A 371 (-4.6A)
None
OBZ  A 371 (-4.2A)
PLP  A 369 ( 3.8A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.35A 2ej3B-3dtgA:
33.2		 2ej3B-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_B_GBNB914_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		8 / 10 PHE A  77
TYR A 144
ARG A 146
TYR A 209
GLY A 313
THR A 314
ALA A 315
ALA A 316
 OBZ  A 371 (-4.6A)
None
OBZ  A 371 (-4.2A)
GOL  A 370 (-3.4A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
None
 0.64A 2ej3B-3dtgA:
33.2		 2ej3B-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_C_GBNC1414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 8 GLY A 254
GLY A 284
THR A 281
ALA A 280
ALA A 283
 None
 1.27A 2ej3C-3dtgA:
32.7		 2ej3C-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_C_GBNC1414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		6 / 8 TYR A 144
ARG A 146
GLY A 243
GLY A 313
THR A 314
ALA A 315
 None
OBZ  A 371 (-4.2A)
PLP  A 369 ( 3.8A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
 0.33A 2ej3C-3dtgA:
32.7		 2ej3C-3dtgA:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_C_GBNC1414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		6 / 8 TYR A 144
ARG A 146
GLY A 313
THR A 314
ALA A 315
ALA A 316
 None
OBZ  A 371 (-4.2A)
PLP  A 369 (-3.6A)
PLP  A 369 (-3.5A)
OBZ  A 371 ( 4.1A)
None
 0.54A 2ej3C-3dtgA:
32.7		 2ej3C-3dtgA:
30.37
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.
3NDI_A_SAMA601_0
(METHYLTRANSFERASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 GLU A 305
ILE A 306
PHE A 248
ALA A 303
ILE A 333
 None
 1.06A 3ndiA-3dtgA:
undetectable		 3ndiA-3dtgA:
23.67
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.
3SUD_A_SUEA1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 GLY A  79
ARG A 108
GLY A 270
ALA A 203
ALA A 202
 None
None
PLP  A 369 (-3.4A)
None
None
 1.08A 3sudA-3dtgA:
undetectable		 3sudA-3dtgA:
21.31
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.
4FGL_D_CLQD303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 GLY A 253
GLY A 254
GLU A 340
ILE A 341
 None
 0.94A 4fglD-3dtgA:
undetectable		 4fglD-3dtgA:
19.95
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.
4KSZ_A_CYSA620_0
(LACTOPEROXIDASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 ARG A 146
GLU A  78
PHE A 119
 OBZ  A 371 (-4.2A)
None
None
 0.85A 4kszA-3dtgA:
undetectable		 4kszA-3dtgA:
20.50
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.
4QZU_C_RTLC201_0
(RETINOL-BINDING
PROTEIN 2)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 120
ALA A 365
VAL A 129
LEU A 143
LEU A 145
 None
 1.01A 4qzuC-3dtgA:
undetectable		 4qzuC-3dtgA:
17.75
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.
4U9U_A_ACTA1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 GLY A 174
ALA A 175
GLY A  30
PRO A  29
 None
 0.93A 4u9uA-3dtgA:
undetectable		 4u9uA-3dtgA:
24.60
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.
4U9U_B_ACTB1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 GLY A 174
ALA A 175
GLY A  30
PRO A  29
 None
 0.97A 4u9uB-3dtgA:
undetectable		 4u9uB-3dtgA:
24.60
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.
4UBE_A_2FAA401_2
(ADENOSINE KINASE)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 4 ALA A 311
VAL A 309
GLY A 339
THR A 342
 None
 1.02A 4ubeA-3dtgA:
undetectable		 4ubeA-3dtgA:
23.35
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.
4X1K_B_LOCB502_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 LEU A 367
LEU A 143
ALA A  82
LEU A  80
ALA A 170
 None
 1.24A 4x1kA-3dtgA:
undetectable
4x1kB-3dtgA:
undetectable		 4x1kA-3dtgA:
18.79
4x1kB-3dtgA:
21.70
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.
5IM2_A_BEZA401_0
(TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 PHE A 248
VAL A 324
ILE A 292
LEU A 246
VAL A 228
 None
 1.19A 5im2A-3dtgA:
undetectable		 5im2A-3dtgA:
23.52
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.
6AK3_B_P2EB1201_1
(PROSTAGLANDIN E2
RECEPTOR EP3
SUBTYPE,SOLUBLE
CYTOCHROME B562)		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 PRO A 261
VAL A 238
GLY A 304
VAL A 309
 None
 1.01A 6ak3B-3dtgA:
undetectable		 6ak3B-3dtgA:
12.54
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.
6N7F_A_RBFA502_0
(PUTATIVE GLUTATHIONE
REDUCTASE (GR))		 3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLY A  32
TYR A 144
GLU A  78
GLY A  79
 None
 0.94A 6n7fA-3dtgA:
undetectable		 6n7fA-3dtgA:
13.39