SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4uw2'

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.
1FAP_A_RAPA108_2
(FK506-BINDING
PROTEIN
FRAP)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 LEU A 505
SER A 509
ARG A 513
GLY A 511
 None
 0.72A 1fapB-4uw2A:
undetectable		 1fapB-4uw2A:
9.53
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_D_BRLD503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 4 ILE A 236
LEU A 331
VAL A 273
ILE A 313
 None
 0.87A 1fm6D-4uw2A:
undetectable		 1fm6D-4uw2A:
16.56
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.
1HWI_B_115B1_2
(HMG-COA REDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A  22
VAL A 186
SER A 187
ASN A 194
 None
 1.08A 1hwiB-4uw2A:
2.8		 1hwiB-4uw2A:
19.97
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.
1ICR_A_NIOA604_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 1.05A 1icrA-4uw2A:
undetectable
1icrB-4uw2A:
undetectable		 1icrA-4uw2A:
14.95
1icrB-4uw2A:
14.95
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.
1ICR_B_NIOB602_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 GLU A 445
GLY A 446
THR A 435
PHE A 451
 None
 1.12A 1icrA-4uw2A:
undetectable
1icrB-4uw2A:
undetectable		 1icrA-4uw2A:
14.95
1icrB-4uw2A:
14.95
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.
1ICU_A_NIOA221_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 1.00A 1icuA-4uw2A:
1.6
1icuB-4uw2A:
1.2		 1icuA-4uw2A:
14.95
1icuB-4uw2A:
14.95
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.
1ICU_B_NIOB219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 GLU A 445
GLY A 446
THR A 435
PHE A 451
 None
 0.99A 1icuA-4uw2A:
1.5
1icuB-4uw2A:
1.4		 1icuA-4uw2A:
14.95
1icuB-4uw2A:
14.95
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.
1ICU_C_NIOC225_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 0.95A 1icuC-4uw2A:
1.2
1icuD-4uw2A:
undetectable		 1icuC-4uw2A:
14.95
1icuD-4uw2A:
14.95
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.
1ICV_C_NIOC708_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 1.03A 1icvC-4uw2A:
undetectable
1icvD-4uw2A:
2.1		 1icvC-4uw2A:
14.95
1icvD-4uw2A:
14.95
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.
1ICV_D_NIOD706_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 GLU A 445
GLY A 446
THR A 435
PHE A 451
 None
 1.05A 1icvC-4uw2A:
undetectable
1icvD-4uw2A:
2.3		 1icvC-4uw2A:
14.95
1icvD-4uw2A:
14.95
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.
1KI7_B_ID2B2_0
(THYMIDINE KINASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 ILE A 333
ILE A 236
ALA A 306
ARG A 314
GLU A 334
 None
 1.43A 1ki7B-4uw2A:
undetectable		 1ki7B-4uw2A:
17.69
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.
1KQB_A_BEZA524_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 1.02A 1kqbA-4uw2A:
undetectable
1kqbB-4uw2A:
undetectable		 1kqbA-4uw2A:
14.02
1kqbB-4uw2A:
14.02
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.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 GLU A 445
GLY A 446
THR A 435
PHE A 451
 None
 1.09A 1kqbA-4uw2A:
undetectable
1kqbB-4uw2A:
undetectable		 1kqbA-4uw2A:
14.02
1kqbB-4uw2A:
14.02
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.
1KQB_C_BEZC522_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 THR A 435
PHE A 451
GLU A 445
GLY A 446
 None
 0.98A 1kqbC-4uw2A:
undetectable
1kqbD-4uw2A:
undetectable		 1kqbC-4uw2A:
14.02
1kqbD-4uw2A:
14.02
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.
1KQB_D_BEZD523_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 GLU A 445
GLY A 446
THR A 435
PHE A 451
 None
 1.06A 1kqbC-4uw2A:
undetectable
1kqbD-4uw2A:
undetectable		 1kqbC-4uw2A:
14.02
1kqbD-4uw2A:
14.02
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.
1MXG_A_ACRA443_1
(ALPHA AMYLASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 SER A  31
THR A  32
LEU A  70
GLU A  69
 None
 1.06A 1mxgA-4uw2A:
undetectable		 1mxgA-4uw2A:
20.65
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.
1NX9_A_AICA5001_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A 755
GLU A 757
GLN A 759
HIS A 676
 None
 1.26A 1nx9A-4uw2A:
undetectable		 1nx9A-4uw2A:
22.26
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.
1NX9_B_AICB5002_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A 755
GLU A 757
GLN A 759
HIS A 676
 None
 1.26A 1nx9B-4uw2A:
undetectable		 1nx9B-4uw2A:
22.26
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.
1NX9_C_AICC5003_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A 755
GLU A 757
GLN A 759
HIS A 676
 None
 1.27A 1nx9C-4uw2A:
undetectable		 1nx9C-4uw2A:
22.26
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.
1NX9_D_AICD5004_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A 755
GLU A 757
GLN A 759
HIS A 676
 None
 1.26A 1nx9D-4uw2A:
undetectable		 1nx9D-4uw2A:
22.26
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.
1P33_C_MTXC353_1
(PTERIDINE REDUCTASE
1)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 ARG A  22
LEU A  38
LEU A 161
LEU A 183
MET A 202
 None
 1.40A 1p33C-4uw2A:
undetectable		 1p33C-4uw2A:
15.90
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.
1RQP_B_SAMB500_1
(5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ASP A 546
PHE A 290
PHE A 529
ALA A 541
 None
 1.11A 1rqpC-4uw2A:
undetectable		 1rqpC-4uw2A:
17.18
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.
1RQP_C_SAMC500_0
(5'-FLUORO-5'-DEOXYAD
ENOSINE SYNTHASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ASP A 546
PHE A 290
PHE A 529
ALA A 541
 None
 1.13A 1rqpA-4uw2A:
undetectable		 1rqpA-4uw2A:
17.18
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.
1T6Z_B_RBFB596_1
(RIBOFLAVIN
KINASE/FMN
ADENYLYLTRANSFERASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 11 VAL A 274
VAL A 288
GLU A 276
LEU A 310
ILE A 236
 None
 1.40A 1t6zB-4uw2A:
undetectable		 1t6zB-4uw2A:
18.52
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.
1TKQ_B_DVAB8_0
(GRAMICIDIN A)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 VAL A 593
GLY A 594
VAL A 517
TRP A 596
 None
 0.87A 1tkqB-4uw2A:
undetectable		 1tkqB-4uw2A:
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.
1W5U_D_DVAD8_0
(GRAMICIDIN D)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 VAL A 622
VAL A 522
TRP A 674
 None
 0.96A 1w5uC-4uw2A:
undetectable
1w5uD-4uw2A:
undetectable		 1w5uC-4uw2A:
2.18
1w5uD-4uw2A:
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.
1XZ1_A_HLTA2001_1
(FERRITIN LIGHT CHAIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 4 LEU A 331
SER A 241
TYR A 330
LEU A 321
 None
 1.29A 1xz1A-4uw2A:
undetectable		 1xz1A-4uw2A:
11.77
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.
1XZ3_A_ICFA201_1
(FERRITIN LIGHT CHAIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 4 LEU A 331
SER A 241
TYR A 330
LEU A 321
 None
 1.30A 1xz3A-4uw2A:
undetectable		 1xz3A-4uw2A:
11.77
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 ILE A 333
ALA A 317
LEU A 321
SER A 241
ILE A 243
 None
 1.15A 2bl9A-4uw2A:
undetectable		 2bl9A-4uw2A:
15.04
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.
2M2P_B_DHIB24_0
(INSULIN B CHAIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 TYR A 552
GLY A 554
PHE A 136
 None
 0.53A 2m2pB-4uw2A:
undetectable		 2m2pB-4uw2A:
4.41
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.
2OUZ_A_C3DA999_0
(ESTROGEN RECEPTOR)		 4uw2 CSM1
(Thermococcus
onnurineus) 		6 / 12 LEU A   9
LEU A  38
LEU A  53
LEU A  55
GLY A  34
HIS A  30
 None
 1.50A 2ouzA-4uw2A:
undetectable		 2ouzA-4uw2A:
15.98
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.
2QD5_B_CHDB1103_0
(FERROCHELATASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ARG A 635
SER A 509
VAL A 517
GLY A 625
 None
 1.00A 2qd5B-4uw2A:
undetectable		 2qd5B-4uw2A:
18.15
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.
2RK8_A_PPFA3969_1
(PHOSPHOENOLPYRUVATE
CARBOXYKINASE,
CYTOSOLIC [GTP])		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 HIS A 201
SER A 188
ASP A  15
ARG A  22
 None
 1.32A 2rk8A-4uw2A:
undetectable		 2rk8A-4uw2A:
23.54
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.
2V7U_A_SAMA1299_0
(5'-FLUORO-5'-DEOXY
ADENOSINE SYNTHETASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 ASP A 546
PHE A 290
PHE A 529
ALA A 541
 None
 1.17A 2v7uA-4uw2A:
undetectable		 2v7uA-4uw2A:
17.18
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.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 LEU A  41
LEU A   9
GLY A  10
MET A 202
LEU A 161
 None
 1.16A 2w8yA-4uw2A:
undetectable		 2w8yA-4uw2A:
16.39
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.
2ZBZ_A_VDXA501_1
(CYTOCHROME P450-SU1)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 11 SER A 172
LEU A 278
VAL A 274
ILE A 298
ALA A 292
 None
 1.23A 2zbzA-4uw2A:
undetectable		 2zbzA-4uw2A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZSE_A_PAUA600_0
(PANTOTHENATE KINASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 7 TYR A 626
PHE A 600
PHE A 604
ILE A 770
 None
 1.22A 2zseA-4uw2A:
undetectable		 2zseA-4uw2A:
17.48
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.
3BJW_A_SVRA508_1
(PHOSPHOLIPASE A2)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 GLN A 481
PHE A 296
ARG A 214
ARG A 171
 None
 1.33A 3bjwE-4uw2A:
undetectable		 3bjwE-4uw2A:
8.94
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.
3HM1_B_J3ZB1_1
(ESTROGEN RECEPTOR)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 11 LEU A 772
LEU A 768
LEU A 699
GLY A 693
LEU A 571
 None
 1.29A 3hm1B-4uw2A:
undetectable		 3hm1B-4uw2A:
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.
3KO0_O_TFPO201_1
(PROTEIN S100-A4)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 GLY A 293
PHE A 544
PHE A 123
GLY A 587
 None
 0.89A 3ko0O-4uw2A:
undetectable
3ko0Q-4uw2A:
undetectable		 3ko0O-4uw2A:
9.22
3ko0Q-4uw2A:
9.22
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.
3KO0_P_TFPP201_1
(PROTEIN S100-A4)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 7 GLY A 587
GLY A 293
PHE A 544
PHE A 123
 None
 0.90A 3ko0M-4uw2A:
undetectable
3ko0P-4uw2A:
undetectable		 3ko0M-4uw2A:
9.22
3ko0P-4uw2A:
9.22
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.
3KP2_B_PNNB5002_0
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 5 ASN A 287
ALA A 207
ALA A 286
ARG A 203
 None
 1.43A 3kp2B-4uw2A:
undetectable		 3kp2B-4uw2A:
13.71
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.
3L8L_D_DVAD8_0
(GRAMICIDIN D)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 VAL A 622
VAL A 522
TRP A 674
 None
 0.89A 3l8lC-4uw2A:
undetectable
3l8lD-4uw2A:
undetectable		 3l8lC-4uw2A:
2.18
3l8lD-4uw2A:
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.
3NVK_I_SAMI228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 ALA A   8
THR A 284
ILE A 208
ASP A 101
ALA A 104
 None
 1.12A 3nvkI-4uw2A:
undetectable		 3nvkI-4uw2A:
15.90
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.
3U5K_B_08JB2_1
(BROMODOMAIN-CONTAINI
NG PROTEIN 4)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 7 TRP A 681
VAL A 764
LEU A 710
ILE A 688
 None
 0.84A 3u5kB-4uw2A:
undetectable		 3u5kB-4uw2A:
9.79
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.
4GH8_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 ILE A 770
ALA A 685
LEU A 680
PRO A 760
ARG A 660
 None
 1.32A 4gh8B-4uw2A:
undetectable		 4gh8B-4uw2A:
12.29
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.
4P65_E_IPHE101_0
(INSULIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 11 ILE A 298
LEU A 310
LEU A 234
ALA A 306
LEU A 281
 None
 1.05A 4p65E-4uw2A:
undetectable
4p65F-4uw2A:
undetectable
4p65J-4uw2A:
undetectable
4p65L-4uw2A:
undetectable		 4p65E-4uw2A:
4.41
4p65F-4uw2A:
5.01
4p65J-4uw2A:
5.01
4p65L-4uw2A:
5.01
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.
4ZBQ_A_DIFA601_1
(SERUM ALBUMIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 11 LEU A 745
VAL A 746
LEU A 705
GLY A 734
LEU A 741
 None
 0.94A 4zbqA-4uw2A:
undetectable		 4zbqA-4uw2A:
21.83
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.
5H5F_A_SAMA301_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
SFM1)		 4uw2 CSM1
(Thermococcus
onnurineus) 		6 / 12 LEU A 281
ILE A 333
GLY A 238
ASP A 239
LEU A 283
ALA A 300
 None
 1.20A 5h5fA-4uw2A:
undetectable		 5h5fA-4uw2A:
14.80
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.
5N8J_E_DVAE7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 TYR A 154
SER A 116
TRP A 131
 None
 0.97A 5n8jB-4uw2A:
undetectable		 5n8jB-4uw2A:
10.77
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.
5N8J_O_DVAO7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 TYR A 154
SER A 116
TRP A 131
 None
 0.96A 5n8jA-4uw2A:
undetectable		 5n8jA-4uw2A:
10.77
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.
5N8J_P_DVAP5_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4uw2 CSM1
(Thermococcus
onnurineus) 		3 / 3 TYR A 154
SER A 116
TRP A 131
 None
 0.99A 5n8jD-4uw2A:
undetectable		 5n8jD-4uw2A:
10.77
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.
5NZ0_A_ZLDA301_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR)		 4uw2 CSM1
(Thermococcus
onnurineus) 		5 / 12 GLY A  17
ILE A  16
TYR A 154
VAL A 186
LEU A  41
 None
 1.23A 5nz0A-4uw2A:
undetectable		 5nz0A-4uw2A:
14.65
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.
5O4Y_A_CCSA14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 PHE A 352
LEU A 103
ARG A 345
GLY A 106
 None
 1.11A 5o4yA-4uw2A:
undetectable		 5o4yA-4uw2A:
2.58
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.
5O4Y_F_CCSF14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 6 PHE A 352
LEU A 103
ARG A 345
GLY A 106
 None
 1.01A 5o4yF-4uw2A:
undetectable		 5o4yF-4uw2A:
2.58
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.
5XU8_A_DX4A701_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 2)		 4uw2 CSM1
(Thermococcus
onnurineus) 		4 / 8 GLY A  11
LEU A  13
SER A  54
PHE A  56
 None
 0.97A 5xu8A-4uw2A:
undetectable		 5xu8A-4uw2A:
18.25