SIMILAR PATTERNS OF AMINO ACIDS FOR 6BRD_A_RFPA502_1

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1ako EXONUCLEASE III

(Escherichia
coli) 		PF03372
(Exo_endo_phos) 		5 LEU A 147
MET A 187
PHE A 266
THR A 244
GLY A 245
 None
 0.91A 6brdA-1akoA:
undetectable		 6brdA-1akoA:
13.96
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.
1brw PROTEIN (PYRIMIDINE
NUCLEOSIDE
PHOSPHORYLASE)

(Geobacillus
stearothermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 HIS A 131
LEU A  93
VAL A 253
PHE A 309
GLY A 317
 None
 1.24A 6brdA-1brwA:
2.7		 6brdA-1brwA:
11.87
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.
1fc4 2-AMINO-3-KETOBUTYRA
TE CONENZYME A
LIGASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 VAL A 235
LEU A 289
VAL A 292
THR A 241
GLY A 240
 None
None
None
PLP  A1201 (-3.4A)
None
 1.32A 6brdA-1fc4A:
undetectable		 6brdA-1fc4A:
16.03
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum) 		PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ) 		5 VAL A 815
MET A 153
PHE A 796
THR A 803
GLY A 804
 None
 1.37A 6brdA-1k32A:
undetectable		 6brdA-1k32A:
6.07
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.
1mpx ALPHA-AMINO ACID
ESTER HYDROLASE

(Xanthomonas
citri) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		5 VAL A 470
PHE A 355
LEU A 302
VAL A 334
GLY A 347
 None
 1.40A 6brdA-1mpxA:
undetectable		 6brdA-1mpxA:
8.83
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.
1mty METHANE
MONOOXYGENASE
HYDROXYLASE

(Methylococcus
capsulatus) 		PF02332
(Phenol_Hydrox) 		5 VAL B 177
MET B  35
VAL D 154
PHE D 236
GLY D 113
 None
 1.22A 6brdA-1mtyB:
undetectable		 6brdA-1mtyB:
11.29
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		5 LEU A  32
MET A 163
VAL A  90
THR A  35
GLY A  36
 None
None
None
None
NAP  A1800 (-3.6A)
 1.45A 6brdA-1o2dA:
undetectable		 6brdA-1o2dA:
13.17
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.
1q5d P450 EPOXIDASE

(Sorangium
cellulosum) 		PF00067
(p450) 		5 VAL A 294
LEU A 413
PHE A 386
THR A 381
GLY A 380
 None
 1.33A 6brdA-1q5dA:
undetectable		 6brdA-1q5dA:
11.93
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.
1qhm PYRUVATE
FORMATE-LYASE

(Escherichia
coli) 		PF02901
(PFL-like) 		5 HIS A1498
VAL A1148
LEU A1486
PHE A1584
GLY A1433
 None
 1.32A 6brdA-1qhmA:
undetectable		 6brdA-1qhmA:
9.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v9l GLUTAMATE
DEHYDROGENASE

(Pyrobaculum
islandicum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 VAL A 303
LEU A 252
VAL A 236
PHE A 272
GLY A 219
 None
None
None
None
NAD  A 430 (-3.4A)
 1.41A 6brdA-1v9lA:
2.7		 6brdA-1v9lA:
13.79
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.
1ybe NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Agrobacterium
tumefaciens) 		PF04095
(NAPRTase) 		5 PHE A 429
VAL A 305
PHE A 311
THR A 294
GLY A 293
 None
 1.09A 6brdA-1ybeA:
undetectable		 6brdA-1ybeA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zlp PETAL DEATH PROTEIN

(Dianthus
caryophyllus) 		PF13714
(PEP_mutase) 		5 VAL A 261
LEU A 125
ARG A  94
PHE A 121
THR A  84
 None
 1.40A 6brdA-1zlpA:
undetectable		 6brdA-1zlpA:
12.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gkd CALC

(Micromonospora
echinospora) 		no annotation 5 HIS A  63
LEU A  77
VAL A  71
PHE A  20
GLY A  45
 None
 1.40A 6brdA-2gkdA:
undetectable		 6brdA-2gkdA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gtx METHIONINE
AMINOPEPTIDASE

(Escherichia
coli) 		PF00557
(Peptidase_M24) 		5 VAL A 164
LEU A 195
VAL A 140
THR A 202
GLY A 170
 None
None
None
MN  A   1 ( 3.7A)
None
 1.41A 6brdA-2gtxA:
undetectable		 6brdA-2gtxA:
16.16
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.
2hun 336AA LONG
HYPOTHETICAL
DTDP-GLUCOSE
4,6-DEHYDRATASE

(Pyrococcus
horikoshii) 		PF16363
(GDP_Man_Dehyd) 		5 HIS A 100
LEU A   7
VAL A  73
THR A 106
GLY A 105
 None
 1.01A 6brdA-2hunA:
4.0		 6brdA-2hunA:
13.69
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.
2obn HYPOTHETICAL PROTEIN

(Trichormus
variabilis) 		PF07755
(DUF1611)
PF17396
(DUF1611_N) 		5 VAL A  77
LEU A 170
THR A 188
GLY A 189
MET A 217
 None
 1.13A 6brdA-2obnA:
2.4		 6brdA-2obnA:
16.29
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.
2obn HYPOTHETICAL PROTEIN

(Trichormus
variabilis) 		PF07755
(DUF1611)
PF17396
(DUF1611_N) 		5 VAL A 106
LEU A 170
THR A 188
GLY A 189
MET A 217
 None
 1.10A 6brdA-2obnA:
2.4		 6brdA-2obnA:
16.29
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.
2odf HYPOTHETICAL PROTEIN
ATU2144

(Agrobacterium
fabrum) 		PF05013
(FGase) 		5 VAL A 194
PHE A 243
LEU A  29
VAL A  27
GLY A 242
 None
 1.20A 6brdA-2odfA:
undetectable		 6brdA-2odfA:
14.62
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.
2og9 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Polaromonas sp.
JS666) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 204
ARG A 196
VAL A 200
THR A 154
GLY A 156
 None
 1.00A 6brdA-2og9A:
undetectable		 6brdA-2og9A:
13.07
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.
2p4z METAL-DEPENDENT
HYDROLASES OF THE
BETA-LACTAMASE
SUPERFAMILY II

(Caldanaerobacter
subterraneus) 		PF00753
(Lactamase_B) 		5 VAL A  23
MET A  62
VAL A  66
THR A  49
GLY A  50
 None
 1.17A 6brdA-2p4zA:
undetectable		 6brdA-2p4zA:
12.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pag HYPOTHETICAL PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF14567
(SUKH_5) 		5 VAL A  60
PHE A  42
VAL A 116
THR A 105
GLY A 104
 None
None
None
CA  A 201 (-3.1A)
None
 1.40A 6brdA-2pagA:
undetectable		 6brdA-2pagA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qez ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Listeria
monocytogenes) 		PF06751
(EutB) 		5 HIS A 227
VAL A 244
VAL A  72
THR A 256
GLY A 259
 None
 1.20A 6brdA-2qezA:
undetectable		 6brdA-2qezA:
12.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qez ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Listeria
monocytogenes) 		PF06751
(EutB) 		5 LEU A 322
ARG A 416
MET A 392
PHE A 321
THR A 220
 None
 1.44A 6brdA-2qezA:
undetectable		 6brdA-2qezA:
12.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qu7 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Staphylococcus
saprophyticus) 		PF13407
(Peripla_BP_4) 		5 HIS A 252
VAL A 293
LEU A 146
PHE A  69
THR A  79
 None
 1.46A 6brdA-2qu7A:
2.9		 6brdA-2qu7A:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rad SUCCINOGLYCAN
BIOSYNTHESIS PROTEIN

(Bacillus cereus) 		PF05139
(Erythro_esteras) 		5 VAL A 140
MET A 287
VAL A 310
PHE A 427
GLY A 407
 None
 1.23A 6brdA-2radA:
undetectable		 6brdA-2radA:
11.71
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] SMALL CHAIN

(Azospirillum
brasilense) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 VAL G  83
LEU G 449
ARG G 203
VAL G 450
GLY G 121
 None
FAD  G 484 (-3.9A)
None
FAD  G 484 (-3.7A)
SF4  G 482 ( 4.0A)
 1.25A 6brdA-2vdcG:
6.4		 6brdA-2vdcG:
11.18
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.
2w3y VIRULENCE FACTOR

(Pectobacterium
carotovorum) 		no annotation 5 VAL A  71
LEU A 155
PHE A 198
THR A 196
GLY A 195
 None
None
None
PLM  A1278 ( 4.8A)
None
 1.05A 6brdA-2w3yA:
undetectable		 6brdA-2w3yA:
14.40
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C

(Cellvibrio
japonicus) 		PF13472
(Lipase_GDSL_2) 		5 HIS A 103
PHE A  36
LEU A 136
ARG A 223
GLY A  37
 None
None
None
GOL  A1350 (-4.4A)
None
 1.45A 6brdA-2waaA:
undetectable		 6brdA-2waaA:
12.54
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.
2wxz ANGIOTENSINOGEN

(Rattus
norvegicus) 		PF00079
(Serpin) 		5 VAL A 130
PHE A 106
LEU A 378
THR A 108
GLY A 107
 None
 1.37A 6brdA-2wxzA:
undetectable		 6brdA-2wxzA:
12.63
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.
2yky BETA-TRANSAMINASE

(Mesorhizobium
sp. LUK) 		PF00202
(Aminotran_3) 		5 HIS A 311
VAL A 139
MET A 322
THR A 314
GLY A 313
 None
 1.26A 6brdA-2ykyA:
undetectable		 6brdA-2ykyA:
11.87
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.
3a21 PUTATIVE SECRETED
ALPHA-GALACTOSIDASE

(Streptomyces
avermitilis) 		PF00652
(Ricin_B_lectin)
PF16499
(Melibiase_2) 		5 VAL A 449
LEU A 342
VAL A 360
THR A 530
GLY A 455
 None
 1.46A 6brdA-3a21A:
undetectable		 6brdA-3a21A:
8.65
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.
3aay PUTATIVE THIOSULFATE
SULFURTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00581
(Rhodanese) 		5 VAL A  27
LEU A 249
VAL A 245
THR A 207
GLY A 111
 None
 1.20A 6brdA-3aayA:
undetectable		 6brdA-3aayA:
14.39
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.
3cc8 PUTATIVE
METHYLTRANSFERASE

(Bacillus cereus) 		PF13489
(Methyltransf_23) 		5 VAL A 111
PHE A  98
LEU A  73
VAL A  56
GLY A  99
 None
 1.45A 6brdA-3cc8A:
3.0		 6brdA-3cc8A:
15.56
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.
3ce2 PUTATIVE PEPTIDASE

(Chlamydia
abortus) 		PF01432
(Peptidase_M3)
PF08439
(Peptidase_M3_N) 		5 HIS A 381
VAL A  86
ARG A  13
PHE A 328
GLY A 358
 None
 1.35A 6brdA-3ce2A:
undetectable		 6brdA-3ce2A:
9.26
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.
3chi P-AMINOBENZOATE
N-OXYGENASE

(Streptomyces
thioluteus) 		PF11583
(AurF) 		5 VAL A  32
LEU A 189
ARG A 239
THR A 197
GLY A 231
 None
 1.24A 6brdA-3chiA:
undetectable		 6brdA-3chiA:
14.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3clq UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF06545
(DUF1116) 		5 VAL A 191
LEU A 216
MET A 208
THR A 289
GLY A 287
 None
 1.31A 6brdA-3clqA:
undetectable		 6brdA-3clqA:
10.98
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.
3du4 ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Bacillus
subtilis) 		PF00202
(Aminotran_3) 		5 HIS A  58
VAL A 341
MET A 276
THR A 283
GLY A 284
 None
 1.33A 6brdA-3du4A:
undetectable		 6brdA-3du4A:
10.71
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.
3evz METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF05175
(MTS) 		5 HIS A  91
LEU A  74
PHE A 153
THR A  89
GLY A  90
 None
 1.42A 6brdA-3evzA:
3.8		 6brdA-3evzA:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h09 IMMUNOGLOBULIN A1
PROTEASE

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		5 PHE A 841
LEU A 871
VAL A 852
THR A 843
GLY A 842
 None
 1.22A 6brdA-3h09A:
undetectable		 6brdA-3h09A:
5.90
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.
3h0k UPF0200 PROTEIN
SSO1041

(Sulfolobus
solfataricus) 		PF13238
(AAA_18) 		5 VAL A 180
LEU A  96
VAL A  99
GLY A  15
MET A  38
 None
 1.35A 6brdA-3h0kA:
undetectable		 6brdA-3h0kA:
19.44
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.
3iv7 ALCOHOL
DEHYDROGENASE IV

(Corynebacterium
glutamicum) 		PF00465
(Fe-ADH) 		5 HIS A  70
LEU A 307
PHE A 312
THR A 250
GLY A 249
 None
 1.37A 6brdA-3iv7A:
undetectable		 6brdA-3iv7A:
17.15
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.
3k17 LIN0012 PROTEIN

(Listeria
innocua) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		5 VAL A 127
VAL A  19
PHE A 217
THR A 353
GLY A 354
 None
 1.24A 6brdA-3k17A:
undetectable		 6brdA-3k17A:
12.54
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.
3mr1 METHIONINE
AMINOPEPTIDASE

(Rickettsia
prowazekii) 		PF00557
(Peptidase_M24) 		5 VAL A 161
LEU A 192
VAL A 137
THR A 199
GLY A 167
 None
None
None
MN  A 249 ( 3.7A)
None
 1.24A 6brdA-3mr1A:
undetectable		 6brdA-3mr1A:
14.57
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.
3n6r PROPIONYL-COA
CARBOXYLASE, BETA
SUBUNIT

(Roseobacter
denitrificans) 		PF01039
(Carboxyl_trans) 		5 VAL B 108
PHE B  79
VAL B 275
THR B 113
GLY B 112
 None
 1.40A 6brdA-3n6rB:
undetectable		 6brdA-3n6rB:
9.98
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.
3nvt 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE SYNTHASE

(Listeria
monocytogenes) 		PF00793
(DAHP_synth_1)
PF01817
(CM_2) 		5 VAL A 204
MET A 291
VAL A 294
PHE A 346
GLY A 124
 None
 1.41A 6brdA-3nvtA:
undetectable		 6brdA-3nvtA:
12.47
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.
3qcw NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		5 PHE A 491
VAL A 585
THR A 517
GLY A 649
MET A 552
 None
 1.37A 6brdA-3qcwA:
undetectable		 6brdA-3qcwA:
7.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT M

(Escherichia
coli) 		no annotation 5 LEU M 471
ARG M 463
PHE M 391
GLY M 360
MET M 460
 None
 1.39A 6brdA-3rkoM:
undetectable		 6brdA-3rkoM:
10.45
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.
3s47 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Clostridium
beijerinckii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 VAL A  11
LEU A 111
VAL A 321
PHE A 115
THR A 290
 None
 1.34A 6brdA-3s47A:
undetectable		 6brdA-3s47A:
12.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t1u PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Azotobacter
vinelandii) 		PF00160
(Pro_isomerase) 		5 VAL A 139
LEU A  13
VAL A 126
THR A  10
GLY A   9
 None
 1.31A 6brdA-3t1uA:
undetectable		 6brdA-3t1uA:
19.63
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.
3tqi GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Coxiella
burnetii) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 VAL A 318
PHE A 294
LEU A 274
VAL A 273
GLY A 263
 None
 1.42A 6brdA-3tqiA:
undetectable		 6brdA-3tqiA:
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.
3uf0 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Beutenbergia
cavernae) 		PF13561
(adh_short_C2) 		5 LEU A  79
VAL A  75
PHE A 126
THR A  15
GLY A  16
 None
None
None
None
NAP  A 274 (-3.8A)
 1.15A 6brdA-3uf0A:
5.2		 6brdA-3uf0A:
15.38
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.
3vc7 PUTATIVE
OXIDOREDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 HIS A  17
VAL A  91
LEU A  85
THR A  23
GLY A  20
 None
 1.43A 6brdA-3vc7A:
5.5		 6brdA-3vc7A:
17.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vqi ATG5

(Kluyveromyces
marxianus) 		PF04106
(APG5) 		5 HIS A 133
PHE A  47
LEU A 116
VAL A  17
THR A  51
 None
 1.37A 6brdA-3vqiA:
undetectable		 6brdA-3vqiA:
17.04
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.
3wel ALPHA-GLUCOSIDASE

(Beta vulgaris) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16863
(NtCtMGAM_N) 		5 VAL A 274
LEU A 111
THR A 554
GLY A 244
MET A 591
 None
 1.24A 6brdA-3welA:
undetectable		 6brdA-3welA:
6.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b56 ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 1

(Mus musculus) 		PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest) 		5 VAL A 551
PHE A 537
LEU A 385
VAL A 382
GLY A 534
 None
 1.16A 6brdA-4b56A:
undetectable		 6brdA-4b56A:
7.27
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.
4bof ARGININE DEIMINASE

(Streptococcus
pyogenes) 		PF02274
(Amidinotransf) 		5 PHE A 196
LEU A 232
VAL A 226
PHE A 259
THR A 173
 None
 1.34A 6brdA-4bofA:
undetectable		 6brdA-4bofA:
11.20
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.
4c1o BETA-XYLOSIDASE

(Parageobacillus
thermoglucosidasius) 		PF03512
(Glyco_hydro_52) 		5 PHE A  84
VAL A 164
PHE A 270
THR A  44
GLY A  52
 None
 1.44A 6brdA-4c1oA:
undetectable		 6brdA-4c1oA:
8.43
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.
4f0e POLY [ADP-RIBOSE]
POLYMERASE 15

(Homo sapiens) 		PF00644
(PARP) 		5 LEU A 535
MET A 522
VAL A 598
THR A 568
GLY A 567
 None
 1.07A 6brdA-4f0eA:
undetectable		 6brdA-4f0eA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fo7 METHIONINE
AMINOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF00557
(Peptidase_M24) 		5 VAL A 163
LEU A 194
VAL A 139
THR A 201
GLY A 169
 None
None
None
MN  A 301 ( 3.8A)
None
 1.44A 6brdA-4fo7A:
undetectable		 6brdA-4fo7A:
16.61
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.
4hz8 BETA-GLUCOSIDASE

(uncultured
bacterium) 		PF00232
(Glyco_hydro_1) 		5 LEU A 287
MET A 335
PHE A 288
THR A 207
GLY A 211
 None
 1.36A 6brdA-4hz8A:
undetectable		 6brdA-4hz8A:
10.45
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.
4ita SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Synechococcus
sp. PCC 7002) 		PF00171
(Aldedh) 		5 LEU A 170
MET A  69
VAL A 166
PHE A 180
MET A 128
 EDO  A 503 ( 4.8A)
None
None
None
None
 1.32A 6brdA-4itaA:
3.0		 6brdA-4itaA:
11.26
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.
4j7b POLO-LIKE KINASE

(Danio rerio) 		PF00069
(Pkinase) 		5 HIS A 160
VAL A 100
PHE A 181
VAL A  70
GLY A 182
 None
 1.40A 6brdA-4j7bA:
undetectable		 6brdA-4j7bA:
23.56
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.
4k5r OXYGENASE

(Streptomyces
argillaceus) 		PF01494
(FAD_binding_3) 		5 HIS A  57
VAL A 227
PHE A 272
GLY A 301
MET A 357
 None
None
FAD  A 601 ( 4.2A)
None
None
 0.76A 6brdA-4k5rA:
53.4		 6brdA-4k5rA:
12.58
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.
4lbw ELONGATION FACTOR
TU-A

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 HIS A  11
VAL A  80
LEU A 304
PHE A 221
GLY A 283
 None
 1.40A 6brdA-4lbwA:
undetectable		 6brdA-4lbwA:
12.25
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.
4nmw PIMELYL-[ACYL-CARRIE
R PROTEIN] METHYL
ESTER ESTERASE

(Salmonella
enterica) 		PF00561
(Abhydrolase_1) 		5 HIS A  20
VAL A  87
LEU A 132
PHE A 136
GLY A  51
 None
 1.27A 6brdA-4nmwA:
undetectable		 6brdA-4nmwA:
15.54
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.
4py4 POLY [ADP-RIBOSE]
POLYMERASE 14

(Homo sapiens) 		PF00644
(PARP) 		5 LEU A1680
MET A1667
VAL A1743
THR A1713
GLY A1712
 None
 1.16A 6brdA-4py4A:
undetectable		 6brdA-4py4A:
18.28
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.
4rvo PHENYLACETATE-COENZY
ME A LIGASE

(Bacteroides
thetaiotaomicron) 		PF00501
(AMP-binding)
PF14535
(AMP-binding_C_2) 		5 HIS A 217
LEU A 121
VAL A 117
PHE A 132
GLY A 213
 None
None
None
None
ADP  A 502 ( 3.7A)
 1.41A 6brdA-4rvoA:
undetectable		 6brdA-4rvoA:
12.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u02 AMINO ACID ABC
TRANSPORTER,
ATP-BINDING PROTEIN

(Thermus
thermophilus) 		PF00005
(ABC_tran) 		5 VAL A  19
LEU A  33
MET A  83
VAL A 192
GLY A  37
 None
 1.34A 6brdA-4u02A:
undetectable		 6brdA-4u02A:
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.
4xpr ALPHA-GLUCOSIDASE

(Pseudopedobacter
saltans) 		PF01055
(Glyco_hydro_31)
PF17137
(DUF5110) 		5 LEU A 302
MET A 482
VAL A 263
PHE A 291
GLY A 268
 None
 1.43A 6brdA-4xprA:
undetectable		 6brdA-4xprA:
9.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zi5 P91

(metagenome) 		PF01738
(DLH) 		5 PHE A 117
LEU A 134
THR A 123
GLY A 121
MET A  64
 None
 1.42A 6brdA-4zi5A:
undetectable		 6brdA-4zi5A:
14.57
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.
5e38 URACIL
PHOSPHORIBOSYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF14681
(UPRTase) 		5 LEU A 177
MET A  82
VAL A 155
THR A 139
GLY A 136
 None
 1.39A 6brdA-5e38A:
undetectable		 6brdA-5e38A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e3x THERMOSTABLE
CARBOXYPEPTIDASE 1

(Fervidobacterium
islandicum) 		PF02074
(Peptidase_M32) 		5 VAL A 463
PHE A 281
PHE A 164
THR A 406
GLY A 280
 None
 1.41A 6brdA-5e3xA:
undetectable		 6brdA-5e3xA:
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ee4 HPUA

(Kingella
denitrificans) 		PF16960
(HpuA) 		5 VAL A 206
LEU A 221
VAL A 214
PHE A 247
GLY A 302
 None
 1.25A 6brdA-5ee4A:
undetectable		 6brdA-5ee4A:
15.61
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.
5ere EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Desulfohalobium
retbaense) 		PF13458
(Peripla_BP_6) 		5 HIS A 447
VAL A 453
VAL A 461
THR A 420
GLY A 419
 None
None
CYT  A 602 (-3.7A)
None
None
 1.10A 6brdA-5ereA:
undetectable		 6brdA-5ereA:
9.82
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.
5f1p PTMO8

(Streptomyces
platensis) 		PF13561
(adh_short_C2) 		5 LEU A  26
VAL A  33
THR A  12
GLY A  13
MET A  74
 None
 1.35A 6brdA-5f1pA:
4.3		 6brdA-5f1pA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2

(Mus musculus) 		PF05175
(MTS) 		5 MET A 334
VAL A 419
PHE A 387
THR A 227
GLY A 226
 None
None
None
None
CA  A1448 ( 4.2A)
 1.21A 6brdA-5fulA:
undetectable		 6brdA-5fulA:
9.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ix1 MORC FAMILY CW-TYPE
ZINC FINGER PROTEIN
3

(Mus musculus) 		PF07496
(zf-CW)
PF13589
(HATPase_c_3) 		5 VAL A 117
PHE A 104
LEU A 251
MET A 264
GLY A 107
 None
 1.22A 6brdA-5ix1A:
undetectable		 6brdA-5ix1A:
13.09
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.
5jy7 MALTOKINASE

(Mycolicibacterium
smegmatis) 		PF01636
(APH) 		5 HIS I 302
VAL I 172
PHE I 322
MET I 192
GLY I 324
 None
 1.41A 6brdA-5jy7I:
undetectable		 6brdA-5jy7I:
12.02
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.
5kvu ISOCITRATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF03971
(IDH) 		5 LEU A 553
MET A 522
THR A 408
GLY A 407
MET A 485
 None
 1.45A 6brdA-5kvuA:
undetectable		 6brdA-5kvuA:
7.77
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.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE

(Homo sapiens) 		PF00264
(Tyrosinase) 		5 HIS A 381
PHE A 400
LEU A 293
THR A 387
GLY A 388
 ZN  A 511 ( 3.3A)
ZN  A 511 ( 4.7A)
None
None
None
 0.91A 6brdA-5m8tA:
undetectable		 6brdA-5m8tA:
11.78
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.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 5 HIS A 103
LEU A 893
VAL A 959
PHE A 895
THR A 970
 CU  A1104 ( 3.5A)
None
None
None
None
 1.44A 6brdA-5n4lA:
undetectable		 6brdA-5n4lA:
20.88
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.
5nl7 CALPONIN HOMOLOGY
DOMAIN PROTEIN
PUTATIVE

(Entamoeba
histolytica) 		no annotation 5 LEU A  49
VAL A  22
PHE A  40
THR A 104
GLY A 106
 None
 1.35A 6brdA-5nl7A:
undetectable		 6brdA-5nl7A:
22.35
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.
5nsq AMINOPEPTIDASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00883
(Peptidase_M17) 		5 LEU A  64
ARG A  57
VAL A  61
PHE A  66
GLY A 105
 None
 1.34A 6brdA-5nsqA:
undetectable		 6brdA-5nsqA:
10.26
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.
5nvm EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4E
TYPE 2

(Homo sapiens) 		PF01652
(IF4E) 		5 HIS A 217
VAL A 170
VAL A 162
THR A 186
GLY A 132
 None
 1.42A 6brdA-5nvmA:
2.1		 6brdA-5nvmA:
17.20
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.
5vdn GLUTATHIONE
OXIDOREDUCTASE

(Yersinia pestis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 HIS A 416
VAL A 221
LEU A 320
VAL A 318
GLY A 363
 None
None
FAD  A 502 (-3.7A)
None
None
 1.19A 6brdA-5vdnA:
11.9		 6brdA-5vdnA:
10.96
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.
5veu CYTOCHROME P450 3A5

(Homo sapiens) 		no annotation 5 VAL A 183
PHE A 446
LEU A 481
VAL A 369
GLY A 443
 None
HEM  A 601 ( 4.9A)
None
HEM  A 601 ( 4.9A)
HEM  A 601 ( 4.0A)
 1.39A 6brdA-5veuA:
undetectable		 6brdA-5veuA:
11.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xfm ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 PHE A 120
LEU A 228
VAL A 239
PHE A 200
THR A 267
 None
 1.45A 6brdA-5xfmA:
undetectable		 6brdA-5xfmA:
23.71
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.
5xfm ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 VAL A  35
PHE A 120
VAL A 239
PHE A 200
THR A 267
 None
 1.44A 6brdA-5xfmA:
undetectable		 6brdA-5xfmA:
23.71
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.
6bj9 ACETYL-COA
ACETYLTRANSFERASE A

(Ascaris suum) 		no annotation 5 VAL A 322
PHE A 288
MET A 121
VAL A  59
GLY A 379
 None
 1.42A 6brdA-6bj9A:
undetectable		 6brdA-6bj9A:
25.00
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT C

(Flavobacterium
johnsoniae) 		no annotation 5 VAL C 238
LEU C 144
VAL C 143
GLY C 127
MET C 134
 None
 1.38A 6brdA-6btmC:
1.4		 6brdA-6btmC:
24.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 7 HIS A  46
PHE A  74
LEU A 176
ARG A 196
PHE A 256
THR A 284
GLY A 285
 None
RFH  A 502 (-3.4A)
FAD  A 501 ( 4.6A)
RFH  A 502 (-3.1A)
RFH  A 502 (-4.4A)
RFH  A 502 (-4.0A)
RFH  A 502 (-3.4A)
 0.73A 6brdA-6c7sA:
63.3		 6brdA-6c7sA:
74.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 6 HIS A  46
PHE A  74
LEU A 176
PHE A 256
THR A 284
GLY A 286
 None
RFH  A 502 (-3.4A)
FAD  A 501 ( 4.6A)
RFH  A 502 (-4.4A)
RFH  A 502 (-4.0A)
FAD  A 501 ( 3.3A)
 1.29A 6brdA-6c7sA:
63.3		 6brdA-6c7sA:
74.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 5 HIS A  46
VAL A  71
ARG A 351
THR A 284
GLY A 285
 None
None
None
RFH  A 502 (-4.0A)
RFH  A 502 (-3.4A)
 1.24A 6brdA-6c7sA:
63.3		 6brdA-6c7sA:
74.03
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.
6caa ELECTROGENIC SODIUM
BICARBONATE
COTRANSPORTER 1

(Homo sapiens) 		no annotation 5 HIS A 807
VAL A 762
PHE A 417
THR A 837
GLY A 836
 None
 1.23A 6brdA-6caaA:
undetectable		 6brdA-6caaA:
22.22
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 5 VAL A 318
LEU A 684
PHE A 688
THR A 370
GLY A 371
 None
 1.37A 6brdA-6ez8A:
undetectable		 6brdA-6ez8A:
8.75