SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3oks'

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.
1A7Y_B_DVAB8_0
(ACTINOMYCIN D)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 THR A  69
THR A  70
PRO A 425
 None
 0.81A 1a7yB-3oksA:
undetectable		 1a7yB-3oksA:
2.18
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.
1DTL_A_BEPA205_1
(CARDIAC TROPONIN C)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 369
LEU A 437
PHE A 422
MET A 381
LEU A 399
 None
 1.17A 1dtlA-3oksA:
undetectable		 1dtlA-3oksA:
17.12
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.
1FBY_A_9CRA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.95A 1fbyA-3oksA:
undetectable		 1fbyA-3oksA:
20.79
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.
1FBY_B_9CRB1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.95A 1fbyB-3oksA:
undetectable		 1fbyB-3oksA:
20.79
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.
1FM6_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.99A 1fm6A-3oksA:
undetectable		 1fm6A-3oksA:
19.73
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.
1HSG_B_MK1B902_1
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 0.98A 1hsgA-3oksA:
undetectable		 1hsgA-3oksA:
13.03
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.
1I3W_G_DVAG2_0
(ACTINOMYCIN D)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 THR A  70
PRO A 425
THR A  69
 None
 0.87A 1i3wG-3oksA:
undetectable		 1i3wG-3oksA:
2.18
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.
1P7L_C_SAMC685_1
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.77A 1p7lD-3oksA:
undetectable		 1p7lD-3oksA:
25.57
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.
1P7L_C_SAMC885_0
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.76A 1p7lC-3oksA:
undetectable		 1p7lC-3oksA:
25.57
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.
1QFI_B_DVAB8_0
(ACTINOMYCIN X2)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 THR A  69
THR A  70
PRO A 425
 None
 0.84A 1qfiB-3oksA:
undetectable		 1qfiB-3oksA:
2.18
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.
1RG9_A_SAMA385_1
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.77A 1rg9B-3oksA:
undetectable		 1rg9B-3oksA:
25.57
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.
1RG9_B_SAMB485_0
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.76A 1rg9A-3oksA:
undetectable		 1rg9A-3oksA:
25.57
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.
1RG9_C_SAMC585_1
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.77A 1rg9D-3oksA:
undetectable		 1rg9D-3oksA:
25.57
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.
1RG9_C_SAMC685_0
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.77A 1rg9C-3oksA:
undetectable		 1rg9C-3oksA:
25.57
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.
1VE3_A_SAMA302_0
(HYPOTHETICAL PROTEIN
PH0226)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		6 / 12 TYR A 322
ALA A 328
GLY A 324
ILE A 294
SER A 301
ALA A 331
 None
 1.46A 1ve3A-3oksA:
undetectable		 1ve3A-3oksA:
19.35
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.
1VE3_B_SAMB301_0
(HYPOTHETICAL PROTEIN
PH0226)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		6 / 12 TYR A 322
ALA A 328
GLY A 324
ILE A 294
SER A 301
ALA A 331
 None
 1.34A 1ve3B-3oksA:
undetectable		 1ve3B-3oksA:
19.35
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.
1XDK_E_9CRE1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.93A 1xdkE-3oksA:
undetectable		 1xdkE-3oksA:
19.69
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.
1XIU_A_9CRA201_1
(RXR-LIKE PROTEIN)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 1.00A 1xiuA-3oksA:
undetectable		 1xiuA-3oksA:
19.65
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.
2CEO_B_T44B1395_1
(THYROXINE-BINDING
GLOBULIN)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 302
GLN A  85
SER A 301
LEU A 300
ASN A 325
 None
 1.40A 2ceoB-3oksA:
undetectable		 2ceoB-3oksA:
21.27
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.
2HW2_A_RFPA1200_1
(RIFAMPIN ADP-RIBOSYL
TRANSFERASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ALA A 291
GLY A 268
GLY A  63
LEU A 423
LEU A 411
 LLP  A 292 ( 2.7A)
None
None
None
None
 0.96A 2hw2A-3oksA:
undetectable		 2hw2A-3oksA:
16.47
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.
2JJP_A_KLNA413_1
(CYTOCHROME P450
113A1)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 PRO A 231
ALA A 221
LEU A 224
THR A 142
ILE A 261
 None
 1.20A 2jjpA-3oksA:
undetectable		 2jjpA-3oksA:
24.12
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.
2QBN_A_CAMA442_0
(CYTOCHROME P450-CAM)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 THR A 158
VAL A 135
VAL A 289
VAL A 303
 None
 1.02A 2qbnA-3oksA:
undetectable		 2qbnA-3oksA:
21.11
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.
2QBN_A_CAMA442_0
(CYTOCHROME P450-CAM)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 THR A 161
VAL A 135
VAL A 289
VAL A 303
 None
 0.88A 2qbnA-3oksA:
undetectable		 2qbnA-3oksA:
21.11
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.
2W1B_A_DXCA2034_0
(ACRIFLAVIN
RESISTANCE PROTEIN B)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 PHE A 238
SER A  64
LEU A  62
 None
 0.76A 2w1bA-3oksA:
undetectable		 2w1bA-3oksA:
19.76
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.
2XKW_B_P1BB1475_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 LEU A 444
ARG A 368
ILE A 369
ILE A 239
 None
 0.89A 2xkwB-3oksA:
undetectable		 2xkwB-3oksA:
22.44
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.
3B2R_A_VDNA1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 LEU A 187
ALA A 185
VAL A 227
PHE A 260
PHE A 245
 None
 1.12A 3b2rA-3oksA:
undetectable		 3b2rA-3oksA:
21.04
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.
3FAL_C_REAC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 1.00A 3falC-3oksA:
undetectable		 3falC-3oksA:
20.13
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.
3FC6_A_REAA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 1.02A 3fc6A-3oksA:
undetectable		 3fc6A-3oksA:
20.13
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.
3FPJ_B_SAMB301_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 TYR A 102
PHE A 124
VAL A 131
ILE A 261
ILE A 288
 None
 1.25A 3fpjB-3oksA:
undetectable		 3fpjB-3oksA:
22.13
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.
3K37_A_BCZA468_0
(NEURAMINIDASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ARG A 358
GLU A 441
LEU A 362
ALA A 406
GLU A 442
 None
 1.36A 3k37A-3oksA:
undetectable		 3k37A-3oksA:
21.58
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.
3K37_B_BCZB468_0
(NEURAMINIDASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ARG A 358
GLU A 441
LEU A 362
ALA A 406
GLU A 442
 None
 1.36A 3k37B-3oksA:
undetectable		 3k37B-3oksA:
21.58
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.
3K4V_D_ROCD201_1
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 0.99A 3k4vC-3oksA:
undetectable		 3k4vC-3oksA:
12.13
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.
3MB5_A_SAMA301_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 GLY A  48
ALA A  75
ILE A  60
ILE A 409
PRO A 424
 None
 1.02A 3mb5A-3oksA:
undetectable		 3mb5A-3oksA:
20.81
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.
3MDV_A_CL6A506_1
(CHOLESTEROL
24-HYDROXYLASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A 265
LEU A 160
ALA A 130
GLU A 132
THR A 158
 LLP  A 292 ( 4.2A)
None
None
None
None
 1.01A 3mdvA-3oksA:
undetectable		 3mdvA-3oksA:
24.22
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.
3OXV_C_478C200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 ALA A 134
VAL A 259
ILE A 309
PRO A 285
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.05A 3oxvD-3oksA:
undetectable		 3oxvD-3oksA:
12.33
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.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.06A 3oxwB-3oksA:
undetectable		 3oxwB-3oksA:
12.33
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.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
PRO A 285
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.02A 3oxwB-3oksA:
undetectable		 3oxwB-3oksA:
12.33
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.
4A7T_A_5FWA1002_1
(SUPEROXIDE DISMUTASE
[CU-ZN])		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 ASN A 256
TRP A 252
ASP A 222
 None
 1.19A 4a7tA-3oksA:
undetectable
4a7tF-3oksA:
undetectable		 4a7tA-3oksA:
16.74
4a7tF-3oksA:
16.74
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.
4DAN_A_2FAA301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 GLY A 127
VAL A 131
GLU A 132
SER A 126
VAL A 265
 LLP  A 292 ( 3.2A)
None
None
LLP  A 292 ( 3.8A)
LLP  A 292 ( 4.2A)
 1.26A 4danA-3oksA:
undetectable		 4danA-3oksA:
19.40
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.
4FFW_A_715A801_2
(DIPEPTIDYL PEPTIDASE
4)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 PHE A 191
TYR A 416
TYR A 189
 None
 0.99A 4ffwA-3oksA:
undetectable		 4ffwA-3oksA:
21.34
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.
4IKJ_A_SUZA201_1
(TRANSTHYRETIN)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 LYS A 209
LEU A 206
ALA A 208
SER A 188
 None
 0.99A 4ikjA-3oksA:
undetectable
4ikjB-3oksA:
undetectable		 4ikjA-3oksA:
14.16
4ikjB-3oksA:
14.16
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.
4IKL_A_SUZA201_1
(TRANSTHYRETIN)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 LYS A 209
LEU A 206
ALA A 208
SER A 188
 None
 0.97A 4iklA-3oksA:
undetectable
4iklB-3oksA:
undetectable		 4iklA-3oksA:
14.16
4iklB-3oksA:
14.16
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.
4K6I_A_9RAA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 1.01A 4k6iA-3oksA:
undetectable		 4k6iA-3oksA:
19.29
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.
4KTT_A_SAMA405_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.72A 4kttB-3oksA:
undetectable		 4kttB-3oksA:
23.08
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.
4KTT_C_SAMC404_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.80A 4kttD-3oksA:
undetectable		 4kttD-3oksA:
23.08
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.
4NDN_A_SAMA407_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.72A 4ndnB-3oksA:
undetectable		 4ndnB-3oksA:
22.98
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.
4NQA_H_9CRH501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.97A 4nqaH-3oksA:
undetectable		 4nqaH-3oksA:
20.90
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.
4RDX_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLU A 230
ARG A 373
GLY A 237
GLY A 234
 LLP  A 292 ( 3.8A)
None
None
None
 0.85A 4rdxA-3oksA:
undetectable		 4rdxA-3oksA:
25.86
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.
5N4T_A_BEZA507_0
(BETA-LACTAMASE VIM-2)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 THR A 321
HIS A  91
ASN A 325
 None
 0.70A 5n4tA-3oksA:
1.3		 5n4tA-3oksA:
21.09
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.
5T8S_B_SAMB402_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 GLU A   6
GLN A   7
ASP A 431
ILE A  60
 None
 0.79A 5t8sA-3oksA:
undetectable		 5t8sA-3oksA:
22.77
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.
5UAN_A_9CRA503_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 1.01A 5uanA-3oksA:
undetectable		 5uanA-3oksA:
20.90
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.
5VCE_A_RITA602_2
(CYTOCHROME P450 3A4)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 6 ARG A 373
ARG A 375
PHE A 245
ILE A 283
 None
 1.04A 5vceA-3oksA:
undetectable		 5vceA-3oksA:
21.75
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.
5Z12_B_9CRB501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.95A 5z12B-3oksA:
undetectable		 5z12B-3oksA:
12.33
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.
5Z12_C_9CRC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.98A 5z12C-3oksA:
undetectable		 5z12C-3oksA:
12.33
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.
6A5Y_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.97A 6a5yD-3oksA:
undetectable		 6a5yD-3oksA:
11.83
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.
6A5Z_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.94A 6a5zD-3oksA:
undetectable		 6a5zD-3oksA:
11.83
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.
6A5Z_L_9CRL501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ILE A 327
ALA A 331
ALA A 330
LEU A 298
ALA A 295
 None
 0.94A 6a5zL-3oksA:
undetectable		 6a5zL-3oksA:
11.83
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.
6BQG_A_ERMA1201_1
(5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 VAL A 265
GLY A 268
ALA A 277
GLU A 132
VAL A 228
 LLP  A 292 ( 4.2A)
None
None
None
None
 1.13A 6bqgA-3oksA:
undetectable		 6bqgA-3oksA:
12.97
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.
6CDU_G_EY4G501_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 ILE A 336
GLN A 108
VAL A 105
ILE A 294
 None
 0.99A 6cduF-3oksA:
undetectable
6cduG-3oksA:
undetectable		 6cduF-3oksA:
20.90
6cduG-3oksA:
20.90
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.
6CDU_G_EY4G502_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 ILE A 336
GLN A 108
VAL A 105
ILE A 294
 None
 1.03A 6cduG-3oksA:
undetectable
6cduH-3oksA:
undetectable		 6cduG-3oksA:
20.90
6cduH-3oksA:
20.90