SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ulk'

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.
1FDU_D_ESTD352_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 GLY A  44
LEU A  67
TYR A  65
GLU A  74
 GLY  A  44 (-0.0A)
LEU  A  67 ( 0.6A)
TYR  A  65 ( 1.3A)
GLU  A  74 (-0.6A)
 1.04A 1fduD-3ulkA:
6.5		 1fduD-3ulkA:
22.69
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.
1JG4_A_SAMA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 GLU A 393
SER A 216
GLU A 221
LEU A 218
 GLU  A 393 (-0.6A)
SER  A 216 ( 0.0A)
GLU  A 221 (-0.6A)
LEU  A 218 ( 0.6A)
 0.86A 1jg4A-3ulkA:
3.6		 1jg4A-3ulkA:
19.79
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.
1JHO_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 9 GLY A 350
GLY A 358
LEU A 253
GLU A 353
GLY A 257
 GLY  A 350 ( 0.0A)
GLY  A 358 ( 0.0A)
LEU  A 253 ( 0.6A)
GLU  A 353 ( 0.5A)
GLY  A 257 ( 0.0A)
 1.31A 1jhoA-3ulkA:
undetectable		 1jhoA-3ulkA:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JHR_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 9 GLY A 350
GLY A 358
LEU A 253
GLU A 353
GLY A 257
 GLY  A 350 ( 0.0A)
GLY  A 358 ( 0.0A)
LEU  A 253 ( 0.6A)
GLU  A 353 ( 0.5A)
GLY  A 257 ( 0.0A)
 1.32A 1jhrA-3ulkA:
undetectable		 1jhrA-3ulkA:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JHY_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 9 GLY A 350
GLY A 358
LEU A 253
GLU A 353
GLY A 257
 GLY  A 350 ( 0.0A)
GLY  A 358 ( 0.0A)
LEU  A 253 ( 0.6A)
GLU  A 353 ( 0.5A)
GLY  A 257 ( 0.0A)
 1.27A 1jhyA-3ulkA:
undetectable		 1jhyA-3ulkA:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 9 GLY A 350
GLY A 358
LEU A 253
GLU A 353
GLY A 257
 GLY  A 350 ( 0.0A)
GLY  A 358 ( 0.0A)
LEU  A 253 ( 0.6A)
GLU  A 353 ( 0.5A)
GLY  A 257 ( 0.0A)
 1.33A 1l4nA-3ulkA:
undetectable		 1l4nA-3ulkA:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS6_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 SER A 112
ARG A 116
ASN A 135
TRP A 320
 SER  A 112 ( 0.0A)
ARG  A 116 ( 0.6A)
ASN  A 135 ( 0.6A)
TRP  A 320 ( 0.5A)
 1.27A 1rs6A-3ulkA:
undetectable		 1rs6A-3ulkA:
21.69
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.
2DTT_C_H4BC1002_1
(HYPOTHETICAL PROTEIN
PH0634)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 ASP A 356
PHE A 355
THR A 260
GLU A 351
 ASP  A 356 ( 0.6A)
PHE  A 355 ( 1.3A)
THR  A 260 ( 0.8A)
GLU  A 351 ( 0.5A)
 1.48A 2dttB-3ulkA:
undetectable
2dttC-3ulkA:
undetectable		 2dttB-3ulkA:
14.26
2dttC-3ulkA:
14.26
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.
2W8Y_A_486A1000_2
(PROGESTERONE
RECEPTOR)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 7 LEU A 406
ASN A 410
LEU A 225
TYR A 426
 LEU  A 406 ( 0.6A)
ASN  A 410 ( 0.6A)
LEU  A 225 ( 0.6A)
TYR  A 426 ( 1.3A)
 1.23A 2w8yA-3ulkA:
undetectable		 2w8yA-3ulkA:
20.27
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.
2X0P_A_ADNA1607_1
(ALCALIGIN
BIOSYNTHESIS PROTEIN)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 GLY A 227
ASN A 410
MET A 409
GLU A 221
 GLY  A 227 ( 0.0A)
ASN  A 410 ( 0.6A)
MET  A 409 ( 0.0A)
GLU  A 221 (-0.6A)
 0.80A 2x0pA-3ulkA:
0.5		 2x0pA-3ulkA:
22.66
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.
2ZIF_A_SAMA298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ALA A 488
PRO A 154
PHE A 169
GLY A 199
THR A 198
 ALA  A 488 ( 0.0A)
PRO  A 154 (-1.1A)
PHE  A 169 ( 1.3A)
GLY  A 199 ( 0.0A)
THR  A 198 ( 0.8A)
 1.04A 2zifA-3ulkA:
undetectable		 2zifA-3ulkA:
20.45
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.
2ZWE_B_DAHB98_1
(TYROSINASE
MELC)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.96A 2zweA-3ulkA:
undetectable
2zweB-3ulkA:
undetectable		 2zweA-3ulkA:
19.11
2zweB-3ulkA:
13.22
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.
2ZWF_B_DAHB98_1
(TYROSINASE
MELC)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.96A 2zwfA-3ulkA:
undetectable
2zwfB-3ulkA:
undetectable		 2zwfA-3ulkA:
19.11
2zwfB-3ulkA:
13.22
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.
2ZWG_B_DAHB98_1
(TYROSINASE
MELC)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 2zwgA-3ulkA:
undetectable
2zwgB-3ulkA:
undetectable		 2zwgA-3ulkA:
19.11
2zwgB-3ulkA:
13.22
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.
3A50_B_VD3B2001_1
(VITAMIN D
HYDROXYLASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 THR A 198
MET A  56
ILE A  63
LEU A 105
ILE A 103
 THR  A 198 ( 0.8A)
MET  A  56 ( 0.0A)
ILE  A  63 ( 0.7A)
LEU  A 105 (-0.5A)
ILE  A 103 ( 0.7A)
 1.29A 3a50B-3ulkA:
undetectable		 3a50B-3ulkA:
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.
3A50_C_VD3C2001_1
(VITAMIN D
HYDROXYLASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 THR A 198
MET A  56
ILE A  63
LEU A 105
ILE A 103
 THR  A 198 ( 0.8A)
MET  A  56 ( 0.0A)
ILE  A  63 ( 0.7A)
LEU  A 105 (-0.5A)
ILE  A 103 ( 0.7A)
 1.31A 3a50C-3ulkA:
undetectable		 3a50C-3ulkA:
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.
3E9X_A_NIMA1_1
(LACTOTRANSFERRIN')		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 4 GLU A 332
GLY A 335
THR A 334
GLU A 340
 GLU  A 332 ( 0.6A)
GLY  A 335 ( 0.0A)
THR  A 334 ( 0.8A)
GLU  A 340 ( 0.6A)
 1.01A 3e9xA-3ulkA:
undetectable		 3e9xA-3ulkA:
21.30
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.
3E9X_A_NIMA1_1
(LACTOTRANSFERRIN')		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 4 GLU A 333
GLY A 335
THR A 337
GLU A 340
 GLU  A 333 ( 0.6A)
GLY  A 335 ( 0.0A)
THR  A 337 ( 0.8A)
GLU  A 340 ( 0.6A)
 1.08A 3e9xA-3ulkA:
undetectable		 3e9xA-3ulkA:
21.30
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.
3H52_D_486D2_1
(GLUCOCORTICOID
RECEPTOR)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 GLY A 232
VAL A 429
MET A 436
LEU A 292
LEU A 439
 GLY  A 232 ( 0.0A)
VAL  A 429 ( 0.6A)
MET  A 436 ( 0.0A)
LEU  A 292 ( 0.5A)
LEU  A 439 ( 0.6A)
 1.43A 3h52D-3ulkA:
undetectable		 3h52D-3ulkA:
20.22
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.
3L4D_A_TPFA490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 PHE A 210
ALA A 176
ALA A 191
LEU A 101
 PHE  A 210 ( 1.3A)
ALA  A 176 ( 0.0A)
ALA  A 191 ( 0.0A)
LEU  A 101 ( 0.6A)
 0.93A 3l4dA-3ulkA:
undetectable		 3l4dA-3ulkA:
21.10
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.
3OHT_B_1N1B2000_1
(P38A)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 ILE A  96
ILE A 143
ILE A 136
ASN A 104
VAL A  43
 ILE  A  96 ( 0.7A)
ILE  A 143 ( 0.7A)
ILE  A 136 ( 0.7A)
ASN  A 104 ( 0.6A)
VAL  A  43 ( 0.6A)
 1.24A 3ohtA-3ulkA:
undetectable
3ohtB-3ulkA:
undetectable		 3ohtA-3ulkA:
22.80
3ohtB-3ulkA:
22.80
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.
3PGY_A_GLYA510_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 GLU A 383
ILE A 382
PHE A 373
ALA A 386
 GLU  A 383 ( 0.6A)
ILE  A 382 ( 0.7A)
PHE  A 373 ( 1.3A)
ALA  A 386 ( 0.0A)
 1.06A 3pgyA-3ulkA:
3.5
3pgyB-3ulkA:
3.6		 3pgyA-3ulkA:
23.61
3pgyB-3ulkA:
23.61
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.
3V4T_A_ACTA503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 ARG A 276
GLU A 263
THR A 260
 ARG  A 276 ( 0.6A)
GLU  A 263 ( 0.6A)
THR  A 260 ( 0.8A)
 0.79A 3v4tA-3ulkA:
undetectable		 3v4tA-3ulkA:
24.39
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.
3WDM_B_ADNB301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 ALA A 363
GLY A 368
LEU A 432
LEU A 371
ILE A 295
 ALA  A 363 ( 0.0A)
GLY  A 368 ( 0.0A)
LEU  A 432 ( 0.5A)
LEU  A 371 ( 0.5A)
ILE  A 295 ( 0.6A)
 1.20A 3wdmB-3ulkA:
undetectable		 3wdmB-3ulkA:
20.33
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.
4CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 THR A 148
ALA A 127
LEU A 101
PHE A 210
ILE A 136
 THR  A 148 ( 0.8A)
ALA  A 127 ( 0.0A)
LEU  A 101 ( 0.6A)
PHE  A 210 ( 1.3A)
ILE  A 136 ( 0.7A)
 1.46A 4claA-3ulkA:
undetectable		 4claA-3ulkA:
17.11
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.
4DXU_A_ACAA711_1
(LACTOTRANSFERRIN)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 GLY A 200
VAL A 205
PRO A 172
TYR A 388
 GLY  A 200 ( 0.0A)
VAL  A 205 ( 0.6A)
PRO  A 172 ( 1.1A)
TYR  A 388 ( 1.3A)
 0.84A 4dxuA-3ulkA:
undetectable		 4dxuA-3ulkA:
20.16
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.
4H1N_A_CGEA505_1
(CYTOCHROME P450 2B4)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ILE A  96
ALA A 126
ALA A 127
ILE A 103
VAL A  43
 ILE  A  96 ( 0.7A)
ALA  A 126 ( 0.0A)
ALA  A 127 ( 0.0A)
ILE  A 103 ( 0.7A)
VAL  A  43 ( 0.6A)
 1.10A 4h1nA-3ulkA:
0.7		 4h1nA-3ulkA:
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.
4MK4_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 PRO A 154
SER A 131
VAL A 152
GLY A 158
 PRO  A 154 (-1.1A)
SER  A 131 (-0.0A)
VAL  A 152 ( 0.6A)
GLY  A 158 ( 0.0A)
 0.96A 4mk4A-3ulkA:
2.9		 4mk4A-3ulkA:
21.44
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.
4O1E_A_C2FA3000_0
(DIHYDROPTEROATE
SYNTHASE DHPS)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ILE A 381
ILE A 270
LEU A 265
GLY A 474
ILE A 470
 ILE  A 381 ( 0.6A)
ILE  A 270 ( 0.7A)
LEU  A 265 ( 0.6A)
GLY  A 474 ( 0.0A)
ILE  A 470 ( 0.6A)
 1.10A 4o1eA-3ulkA:
undetectable		 4o1eA-3ulkA:
20.32
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.
4O1E_B_C2FB4000_0
(DIHYDROPTEROATE
SYNTHASE DHPS)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ILE A 381
ILE A 270
LEU A 265
GLY A 474
ILE A 470
 ILE  A 381 ( 0.6A)
ILE  A 270 ( 0.7A)
LEU  A 265 ( 0.6A)
GLY  A 474 ( 0.0A)
ILE  A 470 ( 0.6A)
 1.16A 4o1eB-3ulkA:
undetectable		 4o1eB-3ulkA:
20.32
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.
4OLB_A_TRPA901_0
(PROTEIN ARGONAUTE-2)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 VAL A 205
ALA A 203
PHE A  22
 VAL  A 205 ( 0.6A)
ALA  A 203 ( 0.0A)
PHE  A  22 ( 1.3A)
 0.84A 4olbA-3ulkA:
undetectable		 4olbA-3ulkA:
19.61
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.
4R21_A_STRA601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 ILE A 190
GLY A 129
ILE A  96
VAL A  40
 ILE  A 190 ( 0.7A)
GLY  A 129 ( 0.0A)
ILE  A  96 ( 0.7A)
VAL  A  40 ( 0.6A)
 0.83A 4r21A-3ulkA:
undetectable		 4r21A-3ulkA:
21.82
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.
4RZV_A_032A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		6 / 12 LEU A 423
SER A 314
SER A 313
PHE A 312
GLY A 420
GLY A 227
 LEU  A 423 ( 0.6A)
SER  A 314 ( 0.0A)
SER  A 313 ( 0.0A)
PHE  A 312 ( 1.3A)
GLY  A 420 ( 0.0A)
GLY  A 227 ( 0.0A)
 1.41A 4rzvA-3ulkA:
undetectable		 4rzvA-3ulkA:
20.46
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.
4UAC_A_ACRA501_2
(CARBOHYDRATE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT1 FAMILY
(TC 3.A.1.1.-))		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 7 SER A 414
GLU A 221
TRP A 320
ASP A 319
 SER  A 414 ( 0.0A)
GLU  A 221 (-0.6A)
TRP  A 320 ( 0.5A)
ASP  A 319 ( 0.6A)
 1.18A 4uacA-3ulkA:
undetectable		 4uacA-3ulkA:
23.20
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.
4W5N_A_IPHA901_0
(PROTEIN ARGONAUTE-2)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 VAL A 205
ALA A 203
PHE A  22
 VAL  A 205 ( 0.6A)
ALA  A 203 ( 0.0A)
PHE  A  22 ( 1.3A)
 0.85A 4w5nA-3ulkA:
undetectable		 4w5nA-3ulkA:
19.61
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.
4X3M_B_ADNB301_1
(RNA 2'-O RIBOSE
METHYLTRANSFERASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 9 LEU A 235
GLY A 232
ILE A 295
LEU A 431
VAL A 429
 LEU  A 235 ( 0.5A)
GLY  A 232 ( 0.0A)
ILE  A 295 ( 0.6A)
LEU  A 431 ( 0.6A)
VAL  A 429 ( 0.6A)
 1.01A 4x3mB-3ulkA:
undetectable		 4x3mB-3ulkA:
21.57
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.
4XJ7_D_ADND303_1
(5'/3'-NUCLEOTIDASE
SURE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 LEU A 431
LEU A 432
SER A 425
ALA A 297
ILE A 295
 LEU  A 431 ( 0.6A)
LEU  A 432 ( 0.5A)
SER  A 425 ( 0.0A)
ALA  A 297 ( 0.0A)
ILE  A 295 ( 0.6A)
 1.04A 4xj7C-3ulkA:
2.8
4xj7D-3ulkA:
2.6		 4xj7C-3ulkA:
20.28
4xj7D-3ulkA:
20.28
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.
4XNX_A_41XA707_1
(TRANSPORTER)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 PHE A  28
ALA A 203
GLY A  24
VAL A 205
GLY A 200
 PHE  A  28 ( 1.3A)
ALA  A 203 ( 0.0A)
GLY  A  24 ( 0.0A)
VAL  A 205 ( 0.6A)
GLY  A 200 ( 0.0A)
 1.25A 4xnxA-3ulkA:
undetectable		 4xnxA-3ulkA:
20.04
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.
4Z4I_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 VAL A 205
ALA A 203
PHE A  22
 VAL  A 205 ( 0.6A)
ALA  A 203 ( 0.0A)
PHE  A  22 ( 1.3A)
 0.87A 4z4iA-3ulkA:
undetectable		 4z4iA-3ulkA:
19.61
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.
5JS1_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 VAL A 205
ALA A 203
PHE A  22
 VAL  A 205 ( 0.6A)
ALA  A 203 ( 0.0A)
PHE  A  22 ( 1.3A)
 0.86A 5js1A-3ulkA:
undetectable		 5js1A-3ulkA:
19.61
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.
5NWU_A_ACAA18_1
(WTFP-TAG,GP41)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ALA A 231
GLY A 232
SER A 233
GLU A 243
LEU A 444
 ALA  A 231 ( 0.0A)
GLY  A 232 ( 0.0A)
SER  A 233 ( 0.0A)
GLU  A 243 ( 0.6A)
LEU  A 444 ( 0.6A)
 0.94A 5nwuA-3ulkA:
undetectable		 5nwuA-3ulkA:
6.31
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.
5TRQ_B_ACTB307_0
(WELO5)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 GLU A 141
HIS A 111
VAL A 115
 GLU  A 141 ( 0.6A)
HIS  A 111 (-1.0A)
VAL  A 115 ( 0.6A)
 0.81A 5trqB-3ulkA:
undetectable		 5trqB-3ulkA:
21.44
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.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ARG A  76
GLY A  44
ALA A  82
PHE A  87
GLY A  90
 ARG  A  76 (-0.6A)
GLY  A  44 (-0.0A)
ALA  A  82 ( 0.0A)
PHE  A  87 ( 1.3A)
GLY  A  90 ( 0.0A)
 0.83A 5xv7A-3ulkA:
undetectable		 5xv7A-3ulkA:
12.41
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 1.04A 5z0fA-3ulkA:
undetectable
5z0fB-3ulkA:
undetectable		 5z0fA-3ulkA:
10.71
5z0fB-3ulkA:
10.00
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.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 5z0gA-3ulkA:
undetectable
5z0gB-3ulkA:
undetectable		 5z0gA-3ulkA:
10.71
5z0gB-3ulkA:
10.00
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.
5Z0H_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.95A 5z0hA-3ulkA:
undetectable
5z0hB-3ulkA:
undetectable		 5z0hA-3ulkA:
10.71
5z0hB-3ulkA:
10.00
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.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 5z0iA-3ulkA:
undetectable
5z0iB-3ulkA:
undetectable		 5z0iA-3ulkA:
10.71
5z0iB-3ulkA:
10.00
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.
5Z0J_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 5z0jA-3ulkA:
undetectable
5z0jB-3ulkA:
undetectable		 5z0jA-3ulkA:
10.71
5z0jB-3ulkA:
10.00
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.
5Z0K_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 5z0kA-3ulkA:
undetectable
5z0kB-3ulkA:
undetectable		 5z0kA-3ulkA:
10.71
5z0kB-3ulkA:
10.00
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.
5Z0L_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.96A 5z0lA-3ulkA:
undetectable
5z0lB-3ulkA:
undetectable		 5z0lA-3ulkA:
10.71
5z0lB-3ulkA:
10.00
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.
5Z0M_B_DAHB98_0
(MELC
TYROSINASE)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 181
HIS A 178
VAL A 177
ASP A 182
PRO A 183
 ASN  A 181 ( 0.6A)
HIS  A 178 ( 1.0A)
VAL  A 177 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 183 ( 1.1A)
 0.97A 5z0mA-3ulkA:
undetectable
5z0mB-3ulkA:
undetectable		 5z0mA-3ulkA:
10.71
5z0mB-3ulkA:
10.00
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.
6GNG_A_QPSA601_2
(-)		 3ulk KETOL-ACID
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 GLY A 204
TRP A 194
HIS A 201
GLU A  27
GLY A  24
 GLY  A 204 ( 0.0A)
TRP  A 194 ( 0.5A)
HIS  A 201 (-1.0A)
GLU  A  27 ( 0.6A)
GLY  A  24 ( 0.0A)
 1.18A 6gngA-3ulkA:
3.8		 6gngA-3ulkA:
21.82