SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4us4'

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.
1CBR_A_REAA200_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
TYPE I)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A 252
ALA A 256
ALA A 260
THR A 231
TYR A  51
 None
None
None
NA  A 702 ( 3.3A)
None
 0.97A 1cbrA-4us4A:
undetectable		 1cbrA-4us4A:
14.35
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.
1CBR_B_REAB200_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
TYPE I)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A 252
ALA A 256
ALA A 260
THR A 231
TYR A  51
 None
None
None
NA  A 702 ( 3.3A)
None
 0.97A 1cbrB-4us4A:
undetectable		 1cbrB-4us4A:
14.35
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.
1DTL_A_BEPA205_1
(CARDIAC TROPONIN C)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 ALA A 270
ILE A 269
LEU A  48
PHE A 208
LEU A 204
 None
 1.04A 1dtlA-4us4A:
undetectable		 1dtlA-4us4A:
15.32
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.
1EQG_A_IBPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 LEU A 204
ILE A 269
ALA A 191
SER A 194
LEU A 195
 None
 1.08A 1eqgA-4us4A:
0.0		 1eqgA-4us4A:
20.92
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.
1EQG_B_IBPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 11 LEU A 204
ILE A 269
ALA A 191
SER A 194
LEU A 195
 None
 1.08A 1eqgB-4us4A:
0.0		 1eqgB-4us4A:
20.92
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.
1HXW_B_RITB301_2
(HIV-1 PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 11 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.95A 1hxwB-4us4A:
undetectable		 1hxwB-4us4A:
12.61
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.
1TKQ_A_DVAA6_0
(MINI-GRAMICIDIN A)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		3 / 3 ALA A 154
VAL A 110
TRP A 114
 78N  A1451 ( 3.7A)
None
None
 1.01A 1tkqA-4us4A:
undetectable		 1tkqA-4us4A:
2.48
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.
1TYR_A_9CRA131_1
(TRANSTHYRETIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 6 LEU A 239
ALA A  26
LEU A 234
THR A 231
 None
NA  A 702 ( 4.8A)
None
NA  A 702 ( 3.3A)
 1.24A 1tyrA-4us4A:
undetectable		 1tyrA-4us4A:
15.07
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.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		3 / 3 SER A 365
THR A 356
GLN A 153
 None
 0.82A 2fk8A-4us4A:
undetectable		 2fk8A-4us4A:
19.87
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.
2PYM_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.94A 2pymA-4us4A:
undetectable		 2pymA-4us4A:
12.61
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.
2PYM_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.95A 2pymB-4us4A:
undetectable		 2pymB-4us4A:
12.61
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.
2Q63_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.96A 2q63B-4us4A:
undetectable		 2q63B-4us4A:
12.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2Q6H_A_CXXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 11 LEU A  29
ARG A  34
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
None
None
TRP  A 601 (-4.4A)
None
None
 0.91A 2q6hA-4us4A:
3.1		 2q6hA-4us4A:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2Q72_A_IXXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 11 LEU A  29
ARG A  34
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
None
None
TRP  A 601 (-4.4A)
None
None
 0.85A 2q72A-4us4A:
40.3		 2q72A-4us4A:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QB4_A_DSMA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A  29
ARG A  34
PHE A 230
ASP A 382
ASP A 385
 None
None
TRP  A 601 (-4.4A)
None
None
 0.80A 2qb4A-4us4A:
40.4		 2qb4A-4us4A:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QB4_A_DSMA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A  29
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
None
TRP  A 601 (-4.4A)
None
None
 0.63A 2qb4A-4us4A:
40.4		 2qb4A-4us4A:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QEI_A_CXXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 11 LEU A  29
ARG A  34
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
None
None
TRP  A 601 (-4.4A)
None
None
 0.85A 2qeiA-4us4A:
40.4		 2qeiA-4us4A:
32.63
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.
2QHC_B_AB1B9001_2
(PROTEASE RETROPEPSIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.95A 2qhcB-4us4A:
undetectable		 2qhcB-4us4A:
12.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QJU_A_DSMA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 11 LEU A  29
ARG A  34
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
None
None
TRP  A 601 (-4.4A)
None
None
 0.82A 2qjuA-4us4A:
40.4		 2qjuA-4us4A:
33.27
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.
2VH3_B_DAHB2_1
(RANASMURFIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 8 ALA A 320
GLY A 109
SER A 324
ALA A 325
 NA  A 701 (-4.1A)
None
NA  A 701 ( 2.4A)
None
 0.89A 2vh3B-4us4A:
1.5		 2vh3B-4us4A:
14.07
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.
2X2N_C_X2NC1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 PHE A 300
PRO A 297
ALA A 191
ALA A 270
LEU A 317
 None
 1.35A 2x2nC-4us4A:
undetectable		 2x2nC-4us4A:
20.68
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.
2XFS_A_J01A500_1
(ORF12)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 8 VAL A 259
LEU A 183
GLY A  28
ALA A 320
 None
None
TRP  A 601 (-3.3A)
NA  A 701 (-4.1A)
 0.88A 2xfsA-4us4A:
undetectable		 2xfsA-4us4A:
23.31
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.
2XH9_A_J01A1436_1
(ORF12)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 8 VAL A 259
LEU A 183
GLY A  28
ALA A 320
 None
None
TRP  A 601 (-3.3A)
NA  A 701 (-4.1A)
 0.88A 2xh9A-4us4A:
undetectable		 2xh9A-4us4A:
23.45
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.
2Z54_A_AB1A200_1
(HIV-1 PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.93A 2z54A-4us4A:
undetectable		 2z54A-4us4A:
12.61
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.
3G4L_C_ROFC903_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		3 / 3 SER A 226
GLN A 227
PHE A 230
 None
None
TRP  A 601 (-4.4A)
 0.66A 3g4lC-4us4A:
undetectable		 3g4lC-4us4A:
19.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GWU_A_SREA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A  29
TYR A 108
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-4.8A)
TRP  A 601 (-4.4A)
None
None
 0.61A 3gwuA-4us4A:
40.5		 3gwuA-4us4A:
33.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GWV_A_RFXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 12 LEU A  29
GLY A  30
ARG A  34
TYR A 108
ILE A 111
PHE A 230
 None
TRP  A 601 (-3.1A)
None
TRP  A 601 (-4.8A)
None
TRP  A 601 (-4.4A)
 0.62A 3gwvA-4us4A:
41.0		 3gwvA-4us4A:
33.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GWV_A_RFXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		7 / 12 LEU A  29
GLY A  30
TYR A 108
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-3.1A)
TRP  A 601 (-4.8A)
None
TRP  A 601 (-4.4A)
None
None
 0.71A 3gwvA-4us4A:
41.0		 3gwvA-4us4A:
33.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GWW_A_SFXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		7 / 12 LEU A  29
GLY A  30
ARG A  34
TYR A 108
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-3.1A)
None
TRP  A 601 (-4.8A)
TRP  A 601 (-4.4A)
None
None
 0.77A 3gwwA-4us4A:
41.0		 3gwwA-4us4A:
33.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GWW_A_SFXA801_1
(TRANSPORTER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		7 / 12 LEU A  29
GLY A  30
TYR A 108
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-3.1A)
TRP  A 601 (-4.8A)
None
TRP  A 601 (-4.4A)
None
None
 0.60A 3gwwA-4us4A:
41.0		 3gwwA-4us4A:
33.08
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		6 / 12 ILE A  60
GLY A  59
ALA A 436
ALA A 228
ALA A  65
VAL A  63
 None
 1.48A 3jb2A-4us4A:
undetectable		 3jb2A-4us4A:
19.03
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.
3NDT_D_ROCD100_2
(PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.93A 3ndtD-4us4A:
undetectable		 3ndtD-4us4A:
12.16
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.
3NVK_I_SAMI228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A  59
ILE A  55
ASP A 263
ALA A 260
VAL A  63
 None
None
NA  A 702 (-2.8A)
None
None
 1.12A 3nvkI-4us4A:
undetectable		 3nvkI-4us4A:
19.41
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.
3OXC_A_ROCA401_1
(PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.94A 3oxcA-4us4A:
undetectable		 3oxcA-4us4A:
12.16
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.
3QPS_A_CHDA211_0
(CMER)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 10 LEU A 358
PHE A 392
ALA A  99
PHE A 102
GLY A 101
 None
 1.28A 3qpsA-4us4A:
undetectable		 3qpsA-4us4A:
17.39
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.
3SJ1_X_DXCX75_0
(CYTOCHROME C7)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 6 ILE A 163
LEU A 322
PHE A 156
GLY A 109
 None
 1.04A 3sj1X-4us4A:
undetectable		 3sj1X-4us4A:
8.86
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.
3SJ4_X_DXCX75_0
(CYTOCHROME C7)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 ILE A 163
LEU A 322
ILE A 158
PHE A 156
GLY A 109
 None
 1.20A 3sj4X-4us4A:
undetectable		 3sj4X-4us4A:
8.62
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.
3W67_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 11 LEU A 291
SER A  36
PHE A 313
ILE A 299
PHE A 275
 None
 0.99A 3w67A-4us4A:
undetectable		 3w67A-4us4A:
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.
3W67_C_VIVC301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A 291
SER A  36
PHE A 313
ILE A 299
PHE A 275
 None
 0.93A 3w67C-4us4A:
undetectable		 3w67C-4us4A:
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.
3W68_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A 291
SER A  36
PHE A 313
ILE A 299
PHE A 275
 None
 0.95A 3w68A-4us4A:
undetectable		 3w68A-4us4A:
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.
3WQW_A_GCSA502_1
(CHITINASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 5 TRP A  33
GLY A 109
ALA A 112
PHE A 139
 None
 1.29A 3wqwA-4us4A:
undetectable		 3wqwA-4us4A:
21.40
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.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 254
ALA A 255
SER A 258
GLY A 261
LEU A 262
 None
 0.86A 4e1gA-4us4A:
undetectable		 4e1gA-4us4A:
22.38
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.
4E1G_B_LNLB701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 254
ALA A 255
SER A 258
GLY A 261
LEU A 262
 None
 0.90A 4e1gB-4us4A:
0.5		 4e1gB-4us4A:
22.38
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.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 ALA A 436
GLY A  53
ILE A  55
GLY A  59
ILE A  60
 None
 1.06A 4eatB-4us4A:
undetectable		 4eatB-4us4A:
24.13
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.
4G19_D_ACTD302_0
(GLUTATHIONE
TRANSFERASE GTE1)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		3 / 3 TYR A  37
PHE A 107
ARG A  34
 None
 1.23A 4g19D-4us4A:
undetectable		 4g19D-4us4A:
20.78
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.
4H2F_A_ADNA601_1
(5'-NUCLEOTIDASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 ASN A  31
GLY A  28
GLY A  30
PHE A 230
ASP A 263
 NA  A 702 ( 2.5A)
TRP  A 601 (-3.3A)
TRP  A 601 (-3.1A)
TRP  A 601 (-4.4A)
NA  A 702 (-2.8A)
 1.43A 4h2fA-4us4A:
undetectable		 4h2fA-4us4A:
22.70
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.
4H2G_A_ADNA603_1
(5'-NUCLEOTIDASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 ASN A  31
GLY A  28
GLY A  30
PHE A 230
ASP A 263
 NA  A 702 ( 2.5A)
TRP  A 601 (-3.3A)
TRP  A 601 (-3.1A)
TRP  A 601 (-4.4A)
NA  A 702 (-2.8A)
 1.37A 4h2gA-4us4A:
undetectable		 4h2gA-4us4A:
22.70
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.
4IAR_A_ERMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A  29
ALA A 388
PHE A 381
SER A 362
PHE A 366
 None
 1.41A 4iarA-4us4A:
undetectable		 4iarA-4us4A:
23.93
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.
4J14_A_X2NA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 10 ALA A 238
LEU A 239
ALA A 260
ALA A 228
THR A 231
 TRP  A 601 ( 3.9A)
None
None
None
NA  A 702 ( 3.3A)
 0.89A 4j14A-4us4A:
0.6		 4j14A-4us4A:
22.40
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.
4J14_A_X2NA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 10 ALA A 238
LEU A 239
VAL A  63
ALA A 260
ALA A 228
 TRP  A 601 ( 3.9A)
None
None
None
None
 1.08A 4j14A-4us4A:
0.6		 4j14A-4us4A:
22.40
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.
4O8F_B_BRLB501_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 6 ILE A  32
PHE A  35
GLY A  30
LEU A 187
 None
None
TRP  A 601 (-3.1A)
None
 0.77A 4o8fB-4us4A:
0.5		 4o8fB-4us4A:
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.
4OAE_A_CLMA207_0
(GNAT SUPERFAMILY
ACETYLTRANSFERASE
PA4794)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 PHE A 230
ALA A 238
ALA A 100
ALA A  93
GLY A  94
 TRP  A 601 (-4.4A)
TRP  A 601 ( 3.9A)
None
None
None
 1.10A 4oaeA-4us4A:
undetectable		 4oaeA-4us4A:
16.20
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.
4OK1_A_198A1001_1
(ANDROGEN RECEPTOR)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 LEU A 316
GLY A 318
LEU A  29
VAL A  27
VAL A 292
 None
None
None
NA  A 702 (-4.7A)
None
 1.16A 4ok1A-4us4A:
undetectable		 4ok1A-4us4A:
21.63
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.
4RP8_C_ASCC501_1
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		3 / 3 SER A 324
TYR A 108
ASP A 263
 NA  A 701 ( 2.4A)
TRP  A 601 (-4.8A)
NA  A 702 (-2.8A)
 0.90A 4rp8C-4us4A:
0.5		 4rp8C-4us4A:
25.20
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.
4WNU_A_QDNA602_1
(CYTOCHROME P450 2D6)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 11 PHE A 314
GLY A 184
LEU A 187
LEU A 179
ALA A 319
 None
 1.08A 4wnuA-4us4A:
0.4		 4wnuA-4us4A:
23.69
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.
4XV2_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 4 GLY A  94
VAL A 331
PHE A 230
ILE A 104
 None
None
TRP  A 601 (-4.4A)
None
 1.10A 4xv2B-4us4A:
0.9		 4xv2B-4us4A:
21.54
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.
5FSA_A_X2NA590_1
(CYP51 VARIANT1)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 PHE A 366
ILE A 143
PHE A 381
LEU A  29
PHE A 156
 None
 1.05A 5fsaA-4us4A:
undetectable		 5fsaA-4us4A:
22.24
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.
5IGW_A_CTYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 ILE A  55
GLY A  53
TYR A  51
GLU A  66
ILE A 440
 None
 1.43A 5igwA-4us4A:
undetectable		 5igwA-4us4A:
21.96
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.
5IGY_A_ERYA403_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		4 / 6 TYR A 193
ASP A 298
ILE A 274
TYR A 122
 None
 1.48A 5igyA-4us4A:
undetectable		 5igyA-4us4A:
21.96
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.
5JGL_A_SAMA301_0
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 ALA A 388
SER A 383
ALA A  99
PHE A 102
SER A 106
 None
 1.09A 5jglA-4us4A:
undetectable		 5jglA-4us4A:
21.43
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.
5TWJ_B_SAMB201_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE H)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 10 ILE A 400
GLY A  94
LEU A 234
SER A 233
LEU A 239
 None
None
None
TRP  A 601 (-2.9A)
None
 0.99A 5twjB-4us4A:
undetectable		 5twjB-4us4A:
17.97
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.
5VKQ_C_PCFC1805_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 9 GLY A  28
LEU A  29
ILE A 115
GLY A 318
ILE A 299
 TRP  A 601 (-3.3A)
None
None
None
None
 0.89A 5vkqC-4us4A:
1.3
5vkqD-4us4A:
1.3		 5vkqC-4us4A:
14.25
5vkqD-4us4A:
14.25
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.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 PHE A 156
ALA A 112
ALA A 256
ALA A 260
THR A 264
 None
 1.12A 6aycA-4us4A:
undetectable		 6aycA-4us4A:
10.57
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.
6DJ1_B_AB1B201_1
(HIV-1 PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.95A 6dj1B-4us4A:
undetectable		 6dj1B-4us4A:
11.47
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.
6DJ2_B_AB1B201_1
(HIV-1 PROTEASE)		 4us4 TRANSPORTER
(Bacillus
halodurans) 		5 / 12 GLY A 396
ALA A  93
VAL A  78
PRO A 332
VAL A 331
 None
 0.95A 6dj2B-4us4A:
undetectable		 6dj2B-4us4A:
10.40