SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1k4q'

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.
1HZE_A_RBFA98_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 9 LEU A  33
LEU A 118
ILE A 126
THR A 156
ILE A  26
 NIY  A 114 ( 4.1A)
NIY  A 114 ( 3.9A)
None
FAD  A 499 (-3.9A)
None
 1.38A 1hzeA-1k4qA:
0.0
1hzeB-1k4qA:
0.0		 1hzeA-1k4qA:
13.43
1hzeB-1k4qA:
13.43
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.
1HZE_B_RBFB99_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 9 THR A 156
ILE A  26
LEU A  33
LEU A 118
ILE A 126
 FAD  A 499 (-3.9A)
None
NIY  A 114 ( 4.1A)
NIY  A 114 ( 3.9A)
None
 1.38A 1hzeA-1k4qA:
0.0
1hzeB-1k4qA:
0.0		 1hzeA-1k4qA:
13.43
1hzeB-1k4qA:
13.43
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.
1MXD_A_ACRA732_1
(ALPHA AMYLASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 9 GLY A  62
GLY A 158
GLY A 157
ASP A 331
ARG A 291
 FAD  A 499 ( 3.7A)
None
FAD  A 499 (-3.4A)
FAD  A 499 (-2.9A)
FAD  A 499 (-3.8A)
 1.11A 1mxdA-1k4qA:
1.1		 1mxdA-1k4qA:
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.
1QKN_A_RALA600_1
(ESTROGEN RECEPTOR
BETA)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		6 / 12 ALA A 155
LEU A 153
LEU A  24
ILE A 125
ILE A 123
LEU A  33
 FAD  A 499 (-4.5A)
None
None
None
None
NIY  A 114 ( 4.1A)
 1.25A 1qknA-1k4qA:
undetectable		 1qknA-1k4qA:
18.62
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.
1UWH_A_BAXA1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 ILE A 205
VAL A 251
ILE A 289
ILE A 168
 None
 0.71A 1uwhA-1k4qA:
undetectable		 1uwhA-1k4qA:
20.09
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.
1UWH_B_BAXB1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 ILE A 205
VAL A 251
ILE A 289
ILE A 168
 None
 0.70A 1uwhB-1k4qA:
undetectable		 1uwhB-1k4qA:
20.09
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.
2BR4_D_SAMD301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 LEU A 298
GLU A  50
GLY A  27
SER A  51
ALA A 155
 None
FAD  A 499 (-2.8A)
FAD  A 499 (-3.3A)
FAD  A 499 (-3.1A)
FAD  A 499 (-4.5A)
 1.08A 2br4D-1k4qA:
2.8		 2br4D-1k4qA:
18.92
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.
2NYU_B_SAMB201_0
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  28
ALA A 155
GLY A 157
LEU A 153
LEU A 118
 FAD  A 499 ( 4.7A)
FAD  A 499 (-4.5A)
FAD  A 499 (-3.4A)
None
NIY  A 114 ( 3.9A)
 1.04A 2nyuB-1k4qA:
3.2		 2nyuB-1k4qA:
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.
2Q6F_C_010C6_0
(INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE
N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		3 / 3 ASN A 294
LEU A 298
HIS A 129
 FAD  A 499 ( 4.5A)
None
FAD  A 499 (-3.4A)
 0.84A 2q6fB-1k4qA:
0.0		 2q6fB-1k4qA:
22.08
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.
2XF3_A_J01A500_1
(ORF12)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 10 ILE A 377
LEU A 215
LEU A 223
GLY A 196
ALA A 199
 None
 1.09A 2xf3A-1k4qA:
0.0		 2xf3A-1k4qA:
21.71
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.
2XZ5_E_ACHE1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 7 ILE A 152
TYR A  21
VAL A  25
TYR A 147
 None
 1.33A 2xz5D-1k4qA:
undetectable
2xz5E-1k4qA:
undetectable		 2xz5D-1k4qA:
19.39
2xz5E-1k4qA:
19.39
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.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 8 ARG A 352
PHE A 354
PRO A 150
GLY A 325
 None
 0.89A 2y6rB-1k4qA:
11.0		 2y6rB-1k4qA:
21.07
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.
3IJX_H_HCZH800_1
(GLUTAMATE RECEPTOR 2)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 5 PRO A 169
SER A 166
LEU A 173
SER A 172
 None
 1.38A 3ijxH-1k4qA:
0.0		 3ijxH-1k4qA:
20.95
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.
3ILU_H_HFZH800_1
(GLUTAMATE RECEPTOR 2)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 5 PRO A 169
SER A 166
LEU A 173
SER A 172
 None
 1.41A 3iluH-1k4qA:
0.0		 3iluH-1k4qA:
20.95
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 TYR A 391
ILE A 433
GLY A 381
PRO A 368
VAL A 451
 None
 0.87A 3jb2A-1k4qA:
3.3		 3jb2A-1k4qA:
18.17
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.
3KK6_B_CELB1701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 SER A 225
LEU A 238
ILE A 230
ALA A 195
 None
 0.87A 3kk6B-1k4qA:
undetectable		 3kk6B-1k4qA:
22.30
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.
3TAJ_A_NBOA700_1
(LACTOTRANSFERRIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 7 THR A 156
GLY A 158
PRO A 293
ASN A 294
 FAD  A 499 (-3.9A)
None
None
FAD  A 499 ( 4.5A)
 0.86A 3tajA-1k4qA:
undetectable		 3tajA-1k4qA:
21.91
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.
3U8Q_A_NPUA7231_1
(LACTOTRANSFERRIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 5 THR A 156
GLY A 158
PRO A 293
ASN A 294
 FAD  A 499 (-3.9A)
None
None
FAD  A 499 ( 4.5A)
 0.87A 3u8qA-1k4qA:
undetectable		 3u8qA-1k4qA:
22.54
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.
3WXO_A_NIZA802_1
(CATALASE-PEROXIDASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 8 LEU A 338
ILE A 367
ASN A 366
GLY A 381
 FAD  A 499 (-3.9A)
None
None
None
 0.87A 3wxoA-1k4qA:
0.0		 3wxoA-1k4qA:
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.
4FJP_A_NPSA711_1
(LACTOTRANSFERRIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 THR A 156
GLY A 158
PRO A 293
ASN A 294
 FAD  A 499 (-3.9A)
None
None
FAD  A 499 ( 4.5A)
 0.91A 4fjpA-1k4qA:
undetectable		 4fjpA-1k4qA:
22.54
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.
4FOR_A_FLPA711_1
(LACTOTRANSFERRIN)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 7 THR A 156
GLY A 158
PRO A 293
ASN A 294
 FAD  A 499 (-3.9A)
None
None
FAD  A 499 ( 4.5A)
 0.82A 4forA-1k4qA:
undetectable		 4forA-1k4qA:
22.54
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.
4K50_A_ACTA506_0
(RNA POLYMERASE
3D-POL)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		3 / 3 VAL A 142
GLY A 144
LYS A 146
 None
 0.72A 4k50A-1k4qA:
0.0		 4k50A-1k4qA:
21.88
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.
4K50_E_ACTE504_0
(RNA POLYMERASE
3D-POL)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		3 / 3 VAL A 142
GLY A 144
LYS A 146
 None
 0.74A 4k50E-1k4qA:
0.0		 4k50E-1k4qA:
21.88
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.
4K50_I_ACTI504_0
(RNA POLYMERASE
3D-POL)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		3 / 3 VAL A 142
GLY A 144
LYS A 146
 None
 0.73A 4k50I-1k4qA:
0.0		 4k50I-1k4qA:
21.88
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.
4L8F_B_MTXB301_1
(GAMMA-GLUTAMYL
HYDROLASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 GLY A 432
GLY A 381
LEU A 382
GLU A 386
HIS A 434
 None
 1.15A 4l8fB-1k4qA:
undetectable		 4l8fB-1k4qA:
21.88
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.
4L8F_D_MTXD301_1
(GAMMA-GLUTAMYL
HYDROLASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 GLY A 432
GLY A 381
LEU A 382
GLU A 386
HIS A 434
 None
 1.17A 4l8fD-1k4qA:
undetectable		 4l8fD-1k4qA:
21.88
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.
4OKX_A_198A1002_1
(ANDROGEN RECEPTOR)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A 346
GLN A 319
LEU A 153
VAL A 332
VAL A  48
 None
 1.17A 4okxA-1k4qA:
undetectable		 4okxA-1k4qA:
18.34
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.
4QVP_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.32A 4qvpV-1k4qA:
undetectable
4qvpb-1k4qA:
undetectable		 4qvpV-1k4qA:
21.27
4qvpb-1k4qA:
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.
4QVP_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.32A 4qvpH-1k4qA:
undetectable
4qvpN-1k4qA:
undetectable		 4qvpH-1k4qA:
21.27
4qvpN-1k4qA:
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.
4QVQ_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.32A 4qvqV-1k4qA:
undetectable
4qvqb-1k4qA:
undetectable		 4qvqV-1k4qA:
21.27
4qvqb-1k4qA:
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.
4QVQ_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.32A 4qvqH-1k4qA:
undetectable
4qvqN-1k4qA:
undetectable		 4qvqH-1k4qA:
21.27
4qvqN-1k4qA:
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.
4XTA_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 9 GLU A 165
LEU A 261
LEU A 285
ILE A 175
 None
 0.87A 4xtaA-1k4qA:
undetectable		 4xtaA-1k4qA:
21.95
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 8 ALA A 155
VAL A  25
GLY A  31
ALA A 342
GLY A 346
 FAD  A 499 (-4.5A)
None
FAD  A 499 (-3.7A)
FAD  A 499 ( 3.7A)
None
 1.26A 4zjzB-1k4qA:
undetectable		 4zjzB-1k4qA:
21.99
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.
5CDP_H_EVPH2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 SER A  51
GLY A 330
ASP A 331
GLY A  31
 FAD  A 499 (-3.1A)
FAD  A 499 (-3.3A)
FAD  A 499 (-2.9A)
FAD  A 499 (-3.7A)
 0.86A 5cdpA-1k4qA:
undetectable
5cdpB-1k4qA:
undetectable		 5cdpA-1k4qA:
22.16
5cdpB-1k4qA:
19.01
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.
5CZY_A_SAMA603_0
(LEGIONELLA EFFECTOR
LEGAS4)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 LEU A  33
GLY A  32
SER A  51
TYR A 114
LEU A 118
 NIY  A 114 ( 4.1A)
None
FAD  A 499 (-3.1A)
NIY  A 114 ( 1.2A)
NIY  A 114 ( 3.9A)
 0.96A 5czyA-1k4qA:
0.0		 5czyA-1k4qA:
20.70
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 5 ALA A 450
PRO A 368
GLY A 334
LEU A 362
 None
 1.02A 5eslA-1k4qA:
0.0		 5eslA-1k4qA:
20.21
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.
5JWA_H_ACTH614_0
(NADH DEHYDROGENASE,
PUTATIVE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		4 / 6 ILE A 168
VAL A 193
VAL A 251
TRP A 287
 None
 0.92A 5jwaH-1k4qA:
24.3		 5jwaH-1k4qA:
20.43
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.
5L5Z_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.29A 5l5zV-1k4qA:
undetectable
5l5zb-1k4qA:
undetectable		 5l5zV-1k4qA:
21.27
5l5zb-1k4qA:
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.
5L5Z_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.31A 5l5zH-1k4qA:
undetectable
5l5zN-1k4qA:
undetectable		 5l5zH-1k4qA:
21.27
5l5zN-1k4qA:
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.
5L66_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.32A 5l66V-1k4qA:
undetectable
5l66b-1k4qA:
undetectable		 5l66V-1k4qA:
21.27
5l66b-1k4qA:
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.
5L66_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 11 HIS A  80
SER A  76
THR A 213
GLY A 204
ALA A 208
 None
 1.33A 5l66H-1k4qA:
undetectable
5l66N-1k4qA:
undetectable		 5l66H-1k4qA:
21.27
5l66N-1k4qA:
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.
5LW1_H_ADNH401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 9 GLY A 157
VAL A 332
ALA A 328
LEU A 153
LEU A 298
 FAD  A 499 (-3.4A)
None
None
None
None
 0.95A 5lw1H-1k4qA:
undetectable		 5lw1H-1k4qA:
12.78
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.
5OY0_2_PQN2843_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 ILE A 326
PHE A 354
ILE A 123
ALA A  36
ALA A 350
 None
 1.26A 5oy02-1k4qA:
0.0		 5oy02-1k4qA:
10.20
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.
6EXI_A_ADNA503_0
(ADENOSYLHOMOCYSTEINA
SE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 10 GLY A  27
GLY A  29
GLU A  50
THR A 156
ASN A 294
 FAD  A 499 (-3.3A)
FAD  A 499 (-3.3A)
FAD  A 499 (-2.8A)
FAD  A 499 (-3.9A)
FAD  A 499 ( 4.5A)
 0.68A 6exiA-1k4qA:
3.6		 6exiA-1k4qA:
9.11
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.
6EXI_B_ADNB503_1
(ADENOSYLHOMOCYSTEINA
SE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 10 GLY A  27
GLY A  29
GLU A  50
THR A 156
ASN A 294
 FAD  A 499 (-3.3A)
FAD  A 499 (-3.3A)
FAD  A 499 (-2.8A)
FAD  A 499 (-3.9A)
FAD  A 499 ( 4.5A)
 0.71A 6exiB-1k4qA:
4.6		 6exiB-1k4qA:
9.11
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.
6EXI_C_ADNC503_0
(ADENOSYLHOMOCYSTEINA
SE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  27
GLY A  29
GLU A  50
THR A 156
ASN A 294
 FAD  A 499 (-3.3A)
FAD  A 499 (-3.3A)
FAD  A 499 (-2.8A)
FAD  A 499 (-3.9A)
FAD  A 499 ( 4.5A)
 0.70A 6exiC-1k4qA:
3.9
6exiD-1k4qA:
4.7		 6exiC-1k4qA:
9.11
6exiD-1k4qA:
9.11
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.
6EXI_D_ADND503_0
(ADENOSYLHOMOCYSTEINA
SE)		 1k4q GLUTATHIONE
REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  27
GLY A  29
GLU A  50
THR A 156
ASN A 294
 FAD  A 499 (-3.3A)
FAD  A 499 (-3.3A)
FAD  A 499 (-2.8A)
FAD  A 499 (-3.9A)
FAD  A 499 ( 4.5A)
 0.70A 6exiC-1k4qA:
3.9
6exiD-1k4qA:
4.7		 6exiC-1k4qA:
9.11
6exiD-1k4qA:
9.11