SIMILAR PATTERNS OF AMINO ACIDS FOR 3UVV_B_9CRB501_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.
1c7k ZINC ENDOPROTEASE

(Streptomyces
caespitosus) 		PF02031
(Peptidase_M7) 		5 ILE A  18
ALA A  21
ALA A  22
LEU A  34
ALA A  82
 None
 1.08A 3uvvB-1c7kA:
undetectable		 3uvvB-1c7kA:
22.90
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.
1ece ENDOCELLULASE E1

(Acidothermus
cellulolyticus) 		PF00150
(Cellulase) 		5 ALA A 143
GLN A 142
PHE A 157
VAL A 101
LEU A  94
 None
 1.16A 3uvvB-1eceA:
undetectable		 3uvvB-1eceA:
20.00
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE

(Hydrogenophaga
pseudoflava) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ILE B 574
ALA B 577
ALA B 578
LEU B 538
ALA B 640
 None
 1.06A 3uvvB-1ffvB:
undetectable		 3uvvB-1ffvB:
15.74
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.
1h81 POLYAMINE OXIDASE

(Zea mays) 		PF01593
(Amino_oxidase) 		5 ALA A  19
ALA A  20
LEU A  31
ALA A 451
VAL A 237
 None
None
None
None
FAD  A 579 (-3.7A)
 1.22A 3uvvB-1h81A:
undetectable		 3uvvB-1h81A:
21.23
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.
1mu2 HIV-2 RT

(Human
immunodeficiency
virus 2) 		PF00075
(RNase_H)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		5 ALA A 268
ALA A 267
GLN A 269
ILE A 257
LEU A 246
 None
 0.95A 3uvvB-1mu2A:
undetectable		 3uvvB-1mu2A:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ILE A1056
VAL A1023
ILE A1021
CYH A1094
LEU A1098
 None
 0.62A 3uvvB-1n5xA:
undetectable		 3uvvB-1n5xA:
10.62
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.
1nmo HYPOTHETICAL PROTEIN
YBGI

(Escherichia
coli) 		PF01784
(NIF3) 		5 ILE A 179
ALA A 182
ALA A 183
ALA A 169
ILE A 200
 None
 0.96A 3uvvB-1nmoA:
undetectable		 3uvvB-1nmoA:
23.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
LEU A 387
ARG A 394
VAL A 418
LEU A 525
 EST  A   1 ( 3.7A)
EST  A   1 (-4.0A)
EST  A   1 (-3.7A)
None
EST  A   1 (-3.6A)
 0.90A 3uvvB-1pcgA:
25.5		 3uvvB-1pcgA:
32.30
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.
1tkk SIMILAR TO
CHLOROMUCONATE
CYCLOISOMERASE

(Bacillus
subtilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 304
ALA A 308
ALA A 311
ILE A 298
LEU A 326
 None
None
None
GLU  A2471 (-4.3A)
None
 1.13A 3uvvB-1tkkA:
undetectable		 3uvvB-1tkkA:
21.47
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.
1tt4 PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF04107
(GCS2) 		5 ILE A  83
ALA A  86
ALA A  87
LEU A  92
ALA A  40
 None
 1.03A 3uvvB-1tt4A:
undetectable		 3uvvB-1tt4A:
22.31
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.
1u7n FATTY
ACID/PHOSPHOLIPID
SYNTHESIS PROTEIN
PLSX

(Enterococcus
faecalis) 		PF02504
(FA_synthesis) 		5 ILE A   3
ALA A  91
ALA A 291
VAL A  21
ILE A  17
 None
 1.19A 3uvvB-1u7nA:
undetectable		 3uvvB-1u7nA:
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.
1ufh YYCN PROTEIN

(Bacillus
subtilis) 		PF00583
(Acetyltransf_1) 		5 ILE A   3
ALA A 112
LEU A  76
ALA A 116
LEU A  96
 None
 1.07A 3uvvB-1ufhA:
undetectable		 3uvvB-1ufhA:
21.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ALA A 342
ALA A 343
GLN A 346
LEU A 380
PHE A 384
ARG A 387
ALA A 398
ILE A 416
CYH A 503
LEU A 507
 MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
MEI  A1001 (-3.8A)
MEI  A1001 (-4.5A)
MEI  A1001 (-3.6A)
MEI  A1001 (-3.4A)
None
MEI  A1001 (-4.0A)
MEI  A1001 (-4.6A)
 0.52A 3uvvB-1uhlA:
36.0		 3uvvB-1uhlA:
88.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 ILE A 339
ALA A 342
ALA A 343
GLN A 346
LEU A 380
PHE A 384
ARG A 387
ALA A 398
VAL A 413
ILE A 416
CYH A 503
 MEI  A1001 (-3.8A)
MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
MEI  A1001 (-3.8A)
MEI  A1001 (-4.5A)
MEI  A1001 (-3.6A)
MEI  A1001 (-3.4A)
MEI  A1001 (-4.1A)
None
MEI  A1001 (-4.0A)
 0.50A 3uvvB-1uhlA:
36.0		 3uvvB-1uhlA:
88.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w52 PANCREATIC LIPASE
RELATED PROTEIN 2

(Equus caballus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 ILE X 134
ALA X 163
PHE X  74
ALA X 160
ILE X  61
 None
 1.28A 3uvvB-1w52X:
undetectable		 3uvvB-1w52X:
19.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		12 ILE A 242
ALA A 245
ALA A 246
GLN A 249
LEU A 283
PHE A 287
ARG A 290
ALA A 301
VAL A 316
ILE A 319
CYH A 406
LEU A 410
 9CR  A 201 ( 4.4A)
9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
9CR  A 201 ( 4.1A)
9CR  A 201 (-4.7A)
9CR  A 201 (-2.8A)
9CR  A 201 (-3.4A)
9CR  A 201 (-4.2A)
None
9CR  A 201 (-3.6A)
9CR  A 201 ( 4.8A)
 0.36A 3uvvB-1xiuA:
32.4		 3uvvB-1xiuA:
81.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 ILE A 268
ALA A 271
ALA A 272
GLN A 275
LEU A 309
PHE A 313
ARG A 316
ALA A 327
VAL A 342
CYH A 432
LEU A 436
 9CR  A 801 (-3.9A)
9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
9CR  A 801 (-4.2A)
9CR  A 801 (-4.3A)
9CR  A 801 (-2.6A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 3.7A)
9CR  A 801 (-4.7A)
 0.43A 3uvvB-1xlsA:
36.0		 3uvvB-1xlsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 ILE A 268
ALA A 271
ALA A 272
GLN A 275
LEU A 309
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
 9CR  A 801 (-3.9A)
9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
9CR  A 801 (-4.2A)
9CR  A 801 (-4.3A)
9CR  A 801 (-2.6A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
9CR  A 801 ( 3.7A)
 0.47A 3uvvB-1xlsA:
36.0		 3uvvB-1xlsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 ILE A 268
ALA A 271
GLN A 275
PHE A 313
VAL A 342
ILE A 345
 9CR  A 801 (-3.9A)
9CR  A 801 (-3.6A)
9CR  A 801 (-4.7A)
9CR  A 801 (-4.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
 1.47A 3uvvB-1xlsA:
36.0		 3uvvB-1xlsA:
100.00
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.
2c4k PHOSPHORIBOSYL
PYROPHOSPHATE
SYNTHETASE-ASSOCIATE
D PROTEIN 1

(Homo sapiens) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		5 ILE A 173
ALA A 184
ALA A 180
ILE A 165
LEU A 158
 None
 1.12A 3uvvB-2c4kA:
undetectable		 3uvvB-2c4kA:
20.53
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.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A  57
ALA A  58
ALA A  29
VAL A 163
LEU A 171
 None
 0.79A 3uvvB-2dpnA:
undetectable		 3uvvB-2dpnA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A  58
LEU A   5
ALA A  29
VAL A 163
LEU A 171
 None
 0.98A 3uvvB-2dpnA:
undetectable		 3uvvB-2dpnA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eyu TWITCHING MOTILITY
PROTEIN PILT

(Aquifex
aeolicus) 		PF00437
(T2SSE) 		5 ILE A 213
ALA A 230
ALA A 227
LEU A 138
ILE A 157
 None
 1.24A 3uvvB-2eyuA:
undetectable		 3uvvB-2eyuA:
22.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gl8 RETINOIC ACID
RECEPTOR RXR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A  88
PHE A  92
ARG A  95
ALA A 106
VAL A 121
ILE A 124
CYH A 211
 None
 0.64A 3uvvB-2gl8A:
28.0		 3uvvB-2gl8A:
85.66
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.
2iqc FANCONI ANEMIA GROUP
F PROTEIN

(Homo sapiens) 		PF11107
(FANCF) 		5 ILE A 205
GLN A 211
LEU A 210
VAL A 247
LEU A 255
 None
 1.29A 3uvvB-2iqcA:
undetectable		 3uvvB-2iqcA:
23.23
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.
2jy9 PUTATIVE TRNA
HYDROLASE DOMAIN

(Salmonella
enterica) 		PF00472
(RF-1) 		5 ILE A  72
ALA A  74
GLN A  75
ALA A  36
ILE A  64
 None
 1.08A 3uvvB-2jy9A:
undetectable		 3uvvB-2jy9A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jza NITRITE REDUCTASE
[NAD(P)H] SMALL
SUBUNIT

(Pectobacterium
atrosepticum) 		PF13806
(Rieske_2) 		5 ALA A  51
ALA A  49
GLN A  50
VAL A  68
LEU A  72
 None
 1.31A 3uvvB-2jzaA:
undetectable		 3uvvB-2jzaA:
18.03
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.
2ksm MYCOBACTERIUM
TUBERCULOSIS
RV0899/MT0922/OMPATB

(Mycobacterium
tuberculosis) 		PF04972
(BON) 		5 ALA A 104
ALA A 105
PHE A  97
ALA A 101
ILE A  84
 None
 1.23A 3uvvB-2ksmA:
undetectable		 3uvvB-2ksmA:
20.00
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.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ALA A 350
LEU A 387
ARG A 394
VAL A 418
LEU A 525
 EST  A 596 ( 3.9A)
EST  A 596 ( 4.2A)
EST  A 596 (-4.0A)
CME  A 417 ( 3.2A)
EST  A 596 (-3.6A)
 0.82A 3uvvB-2ocfA:
25.8		 3uvvB-2ocfA:
29.33
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.
2opc AVRL567-A

(Melampsora lini) 		PF11529
(AvrL567-A) 		5 ALA A 114
GLN A 115
VAL A  49
ILE A  50
LEU A 146
 None
 1.25A 3uvvB-2opcA:
undetectable		 3uvvB-2opcA:
20.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q60 RETINOID X RECEPTOR

(Polyandrocarpa
misakiensis) 		PF00104
(Hormone_recep) 		7 LEU A 184
PHE A 188
ARG A 191
ALA A 202
VAL A 217
ILE A 220
CYH A 307
 None
 0.67A 3uvvB-2q60A:
27.0		 3uvvB-2q60A:
71.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vml PHYCOCYANIN ALPHA
CHAIN
PHYCOCYANIN BETA
CHAIN

(Gloeobacter
violaceus) 		PF00502
(Phycobilisome) 		5 ALA A  40
ALA A  41
ALA A 150
VAL B  31
LEU B  24
 None
 0.84A 3uvvB-2vmlA:
undetectable		 3uvvB-2vmlA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wvq SMALL S PROTEIN

(Podospora
anserina) 		PF14479
(HeLo) 		5 ALA A 214
ALA A 215
LEU A 200
ARG A  54
ALA A 184
 None
 1.23A 3uvvB-2wvqA:
undetectable		 3uvvB-2wvqA:
25.38
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.
2xax RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
SUBUNIT ALPHA

(Escherichia
coli) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		5 ILE A  62
ALA A  66
ALA A  65
ALA A  81
ILE A  53
 None
 1.20A 3uvvB-2xaxA:
undetectable		 3uvvB-2xaxA:
16.69
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.
2yyv PROBABLE
2-PHOSPHOSULFOLACTAT
E PHOSPHATASE

(Thermotoga
maritima) 		PF04029
(2-ph_phosp) 		5 ILE A  29
ALA A  32
LEU A 223
ALA A  37
ILE A 109
 None
 1.13A 3uvvB-2yyvA:
undetectable		 3uvvB-2yyvA:
24.00
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.
3a5v ALPHA-GALACTOSIDASE

(Umbelopsis
vinacea) 		PF16499
(Melibiase_2) 		5 ILE A  28
ALA A  31
ALA A  32
LEU A  88
ILE A  92
 None
 1.21A 3uvvB-3a5vA:
undetectable		 3uvvB-3a5vA:
20.15
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.
3am6 RHODOPSIN-2

(Acetabularia
acetabulum) 		PF01036
(Bac_rhodopsin) 		5 ILE A  44
ALA A  47
VAL A  95
CYH A 218
LEU A 219
 None
None
None
None
CLR  A 401 ( 4.6A)
 0.89A 3uvvB-3am6A:
undetectable		 3uvvB-3am6A:
21.74
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.
3aqc COMPONENT A OF
HEXAPRENYL
DIPHOSPHATE SYNTHASE
COMPONENT B OF
HEXAPRENYL
DIPHOSPHATE SYNTHASE

(Micrococcus
luteus) 		PF00348
(polyprenyl_synt)
no annotation 		5 ILE B 123
GLN A  89
LEU A  93
PHE A  92
VAL B  76
 None
None
None
None
2DE  B 329 ( 4.5A)
 1.22A 3uvvB-3aqcB:
undetectable		 3uvvB-3aqcB:
20.66
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.
3c1a PUTATIVE
OXIDOREDUCTASE

(Magnetospirillum
magnetotacticum) 		PF01408
(GFO_IDH_MocA) 		5 ALA A 113
ALA A 112
ALA A 117
ILE A  74
LEU A 101
 None
 1.27A 3uvvB-3c1aA:
undetectable		 3uvvB-3c1aA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cp2 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME GIDA

(Escherichia
coli) 		PF01134
(GIDA)
PF13932
(GIDA_assoc) 		5 ALA A 387
LEU A 357
ALA A  17
VAL A 135
ILE A 362
 None
None
SO4  A 630 (-3.2A)
None
None
 1.27A 3uvvB-3cp2A:
undetectable		 3uvvB-3cp2A:
16.54
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.
3ddd PUTATIVE
ACETYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF00583
(Acetyltransf_1) 		5 ILE A 155
ALA A 199
LEU A 197
PHE A 186
ALA A 181
 None
 1.17A 3uvvB-3dddA:
undetectable		 3uvvB-3dddA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3djc TYPE III
PANTOTHENATE KINASE

(Legionella
pneumophila) 		PF03309
(Pan_kinase) 		5 ALA A 115
ALA A 116
LEU A 220
VAL A 105
CYH A 137
 None
 0.94A 3uvvB-3djcA:
undetectable		 3uvvB-3djcA:
21.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		11 ILE A 268
ALA A 271
ALA A 272
GLN A 275
LEU A 309
PHE A 313
ARG A 316
VAL A 342
ILE A 345
CYH A 432
LEU A 436
 9CR  A7223 (-3.9A)
9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
9CR  A7223 ( 4.4A)
9CR  A7223 (-4.5A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
9CR  A7223 ( 4.7A)
 0.55A 3uvvB-3dzuA:
34.1		 3uvvB-3dzuA:
51.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		10 ILE A 268
ALA A 272
GLN A 275
LEU A 309
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
 9CR  A7223 (-3.9A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
9CR  A7223 ( 4.4A)
9CR  A7223 (-4.5A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.7A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
 0.62A 3uvvB-3dzuA:
34.1		 3uvvB-3dzuA:
51.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 ILE A 268
ALA A 272
PHE A 313
VAL A 342
ILE A 345
 9CR  A7223 (-3.9A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.5A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
 1.25A 3uvvB-3dzuA:
34.1		 3uvvB-3dzuA:
51.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3eyb NUCLEAR HORMONE
RECEPTOR RXR

(Branchiostoma
floridae) 		PF00104
(Hormone_recep) 		5 LEU A 338
PHE A 342
VAL A 371
ILE A 374
CYH A 461
 None
 0.63A 3uvvB-3eybA:
28.8		 3uvvB-3eybA:
84.14
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.
3f0w NUMB-LIKE PROTEIN

(Homo sapiens) 		PF00640
(PID) 		5 LEU A  85
ALA A 176
VAL A 144
ILE A 160
CYH A 171
 None
 1.28A 3uvvB-3f0wA:
undetectable		 3uvvB-3f0wA:
22.27
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.
3g0o 3-HYDROXYISOBUTYRATE
DEHYDROGENASE

(Salmonella
enterica) 		PF03446
(NAD_binding_2)
PF14833
(NAD_binding_11) 		5 ILE A  11
ALA A  35
ALA A  41
VAL A 156
LEU A  67
 None
 1.16A 3uvvB-3g0oA:
undetectable		 3uvvB-3g0oA:
22.36
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.
3g23 LD-CARBOXYPEPTIDASE
A

(Novosphingobium
aromaticivorans) 		PF02016
(Peptidase_S66) 		5 ALA A 112
ALA A 111
LEU A 174
ALA A  84
LEU A 183
 None
 1.04A 3uvvB-3g23A:
undetectable		 3uvvB-3g23A:
20.62
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.
3hp0 PUTATIVE POLYKETIDE
BIOSYNTHESIS
ENOYL-COA HYDRATASE
HOMOLOG PKSH

(Bacillus
subtilis) 		PF00378
(ECH_1) 		5 ALA A 121
PHE A 118
ILE A   9
CYH A  39
LEU A  43
 None
 1.19A 3uvvB-3hp0A:
undetectable		 3uvvB-3hp0A:
24.33
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.
3i1c DIISOPROPYL-FLUOROPH
OSPHATASE

(Loligo vulgaris) 		PF08450
(SGL) 		5 ALA A 175
ALA A 193
PHE A 171
ALA A 173
ILE A 211
 None
None
GOL  A 325 (-3.4A)
None
None
 1.30A 3uvvB-3i1cA:
undetectable		 3uvvB-3i1cA:
22.02
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.
3ic6 PUTATIVE METHYLASE
FAMILY PROTEIN

(Neisseria
gonorrhoeae) 		PF00588
(SpoU_methylase) 		5 ILE A  28
ALA A  32
ALA A  31
ALA A  83
LEU A 176
 None
 1.20A 3uvvB-3ic6A:
undetectable		 3uvvB-3ic6A:
22.46
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.
3ik4 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Herpetosiphon
aurantiacus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 179
ALA A 182
LEU A 153
VAL A 190
ILE A 189
 None
 1.21A 3uvvB-3ik4A:
undetectable		 3uvvB-3ik4A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kyf PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
putida) 		PF07238
(PilZ)
PF07317
(YcgR) 		5 ALA A 224
GLN A 225
PHE A 217
VAL A 136
ILE A 138
 None
 0.87A 3uvvB-3kyfA:
undetectable		 3uvvB-3kyfA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nze PUTATIVE
TRANSCRIPTIONAL
REGULATOR,
SUGAR-BINDING FAMILY

(Paenarthrobacter
aurescens) 		PF04198
(Sugar-bind) 		5 ILE A 279
ALA A  98
GLN A  97
ILE A 112
LEU A 120
 None
 1.13A 3uvvB-3nzeA:
undetectable		 3uvvB-3nzeA:
19.22
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.
3p45 CASPASE-6

(Homo sapiens) 		PF00656
(Peptidase_C14) 		5 ILE A 127
ALA A 162
GLN A 161
LEU A 119
ILE A 100
 None
 1.18A 3uvvB-3p45A:
undetectable		 3uvvB-3p45A:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qbd 3-DEHYDROQUINATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF01761
(DHQ_synthase) 		5 ALA A  49
ALA A  52
LEU A 104
VAL A  89
ILE A  86
 None
 1.10A 3uvvB-3qbdA:
undetectable		 3uvvB-3qbdA:
23.50
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.
3qr8 BASEPLATE ASSEMBLY
PROTEIN V

(Escherichia
virus P2) 		PF04717
(Phage_base_V) 		5 ILE A  69
ALA A  71
ALA A  79
ILE A  23
CYH A  33
 None
 1.13A 3uvvB-3qr8A:
undetectable		 3uvvB-3qr8A:
24.38
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.
3sr6 XANTHINE
DEHYDROGENASE/OXIDAS
E

(Bos taurus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ILE C1056
VAL C1023
ILE C1021
CYH C1094
LEU C1098
 None
 0.61A 3uvvB-3sr6C:
undetectable		 3uvvB-3sr6C:
15.33
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.
3u9r METHYLCROTONYL-COA
CARBOXYLASE,
BETA-SUBUNIT

(Pseudomonas
aeruginosa) 		PF01039
(Carboxyl_trans) 		5 ILE B 119
ALA B 116
ALA B 117
ALA B 102
ILE B 194
 None
 1.16A 3uvvB-3u9rB:
undetectable		 3uvvB-3u9rB:
18.48
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.
3wxy PUTATIVE
UNCHARACTERIZED
PROTEIN CSYB

(Aspergillus
oryzae) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ILE A 183
ALA A 181
LEU A 168
ILE A 159
LEU A 150
 None
 1.32A 3uvvB-3wxyA:
undetectable		 3uvvB-3wxyA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zh9 DELTA

(Bacillus
subtilis) 		PF06144
(DNA_pol3_delta) 		5 LEU B  86
ALA B 133
VAL B  78
ILE B  79
LEU B  54
 None
GOL  B1347 ( 4.3A)
None
None
None
 1.28A 3uvvB-3zh9B:
undetectable		 3uvvB-3zh9B:
24.23
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.
4crm EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF03464
(eRF1_2)
PF03465
(eRF1_3) 		5 ALA X 206
ALA X 203
LEU X 243
ILE X 250
LEU X 233
 None
 1.12A 3uvvB-4crmX:
undetectable		 3uvvB-4crmX:
23.15
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.
4g0o PROTEIN ARGONAUTE 5

(Arabidopsis
thaliana) 		PF02171
(Piwi) 		5 ILE A 629
ALA A 611
ILE A 653
CYH A 657
LEU A 661
 None
 1.19A 3uvvB-4g0oA:
undetectable		 3uvvB-4g0oA:
20.26
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.
4g0o PROTEIN ARGONAUTE 5

(Arabidopsis
thaliana) 		PF02171
(Piwi) 		5 ILE A 629
ALA A 633
ALA A 611
ILE A 653
CYH A 657
 None
 1.01A 3uvvB-4g0oA:
undetectable		 3uvvB-4g0oA:
20.26
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.
4gr4 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
lydicus) 		PF00501
(AMP-binding)
PF03621
(MbtH) 		5 ALA A  88
ARG A  84
ALA A  85
VAL A 136
LEU A  92
 None
 1.24A 3uvvB-4gr4A:
undetectable		 3uvvB-4gr4A:
21.02
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.
4gr5 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
lydicus) 		PF00501
(AMP-binding)
PF03621
(MbtH) 		5 ALA A  88
ARG A  84
ALA A  85
VAL A 136
LEU A  92
 None
None
CL  A 603 ( 4.5A)
None
None
 1.27A 3uvvB-4gr5A:
undetectable		 3uvvB-4gr5A:
19.08
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.
4hva CASPASE-6

(Homo sapiens) 		PF00656
(Peptidase_C14) 		5 ILE A 127
ALA A 162
GLN A 161
LEU A 119
ILE A 100
 None
 1.19A 3uvvB-4hvaA:
undetectable		 3uvvB-4hvaA:
20.85
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.
4hzu ENERGY-COUPLING
FACTOR TRANSPORTER
ATP-BINDING PROTEIN
ECFA 1
ENERGY-COUPLING
FACTOR TRANSPORTER
ATP-BINDING PROTEIN
ECFA 2

(Lactobacillus
brevis) 		PF00005
(ABC_tran) 		5 ALA B 250
ALA B 271
LEU A 247
ALA B 254
ILE A 201
 None
 1.23A 3uvvB-4hzuB:
undetectable		 3uvvB-4hzuB:
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		5 ILE A  12
ALA A  35
ALA A  44
VAL A 230
ILE A 231
 None
 0.96A 3uvvB-4ituA:
undetectable		 3uvvB-4ituA:
23.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 12 ILE D 268
ALA D 271
ALA D 272
GLN D 275
LEU D 309
PHE D 313
ARG D 316
ALA D 327
VAL D 342
ILE D 345
CYH D 432
LEU D 436
 None
 0.48A 3uvvB-4j5xD:
35.4		 3uvvB-4j5xD:
95.56
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.
4mq3 INTEGRASE

(Feline
immunodeficiency
virus) 		PF00665
(rve) 		5 ALA A 102
GLN A 105
VAL A 153
ILE A  79
LEU A 115
 None
 0.97A 3uvvB-4mq3A:
undetectable		 3uvvB-4mq3A:
20.58
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.
4mtn TRANSCRIPTION
TERMINATION FACTOR
NUSA

(Planctopirus
limnophila) 		PF00575
(S1)
PF08529
(NusA_N)
PF13184
(KH_5)
PF14520
(HHH_5) 		5 ILE A  32
ALA A  36
ALA A  35
VAL A   6
ILE A   9
 None
 1.22A 3uvvB-4mtnA:
undetectable		 3uvvB-4mtnA:
21.20
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.
4mx8 PERIPLASMIC BINDING
PROTEIN

(Xylanimonas
cellulosilytica) 		PF01497
(Peripla_BP_2) 		5 ILE A  65
ALA A  82
ALA A  85
VAL A 108
ILE A 107
 None
 1.21A 3uvvB-4mx8A:
undetectable		 3uvvB-4mx8A:
21.05
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.
4nn1 TRANSCRIPTIONAL
REGULATOR

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		5 ILE A  12
ALA A  15
ALA A  16
GLN A  19
ALA A  35
 None
 0.51A 3uvvB-4nn1A:
undetectable		 3uvvB-4nn1A:
26.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nzs BETA-KETOTHIOLASE
BKTB

(Cupriavidus
necator) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ILE A  97
ALA A 100
ALA A 101
ALA A 112
VAL A 377
 None
 1.20A 3uvvB-4nzsA:
undetectable		 3uvvB-4nzsA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o48 UNCHARACTERIZED
PROTEIN

(Cavia porcellus) 		PF01112
(Asparaginase_2) 		5 ALA A  31
ALA A  30
LEU A  55
ALA A 287
ILE A  81
 None
 1.15A 3uvvB-4o48A:
undetectable		 3uvvB-4o48A:
24.00
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.
4ydh FORMIN-LIKE PROTEIN
1

(Homo sapiens) 		PF06367
(Drf_FH3)
PF06371
(Drf_GBD) 		5 ILE A 288
ALA A 291
ALA A 292
VAL A 282
LEU A 276
 None
 1.23A 3uvvB-4ydhA:
undetectable		 3uvvB-4ydhA:
21.41
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.
4ywo MERCURIC REDUCTASE

(Metallosphaera
sedula) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ILE A   7
ALA A 129
ALA A 290
VAL A 116
ILE A 121
 FAD  A 501 ( 4.9A)
None
None
None
None
 1.29A 3uvvB-4ywoA:
undetectable		 3uvvB-4ywoA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yxx DTOR_6X35L

(synthetic
construct) 		no annotation 5 ILE A   9
ALA A  13
ALA A  23
LEU A  45
VAL A   1
 None
 1.13A 3uvvB-4yxxA:
undetectable		 3uvvB-4yxxA:
26.25
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.
4z3l MAJOR POLLEN
ALLERGEN BET V 1-A

(Betula pendula) 		PF00407
(Bet_v_1) 		5 ALA A 146
LEU A  29
PHE A  30
ILE A 102
LEU A  18
 None
 0.92A 3uvvB-4z3lA:
undetectable		 3uvvB-4z3lA:
19.50
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.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ILE A 117
ALA A 120
ALA A 119
VAL A 321
ILE A 322
 None
 1.02A 3uvvB-5aw4A:
undetectable		 3uvvB-5aw4A:
12.65
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.
5b3r IMP-18

(Pseudomonas
aeruginosa) 		no annotation 5 ILE A 171
ALA A 208
ALA A 221
VAL A  56
ILE A  65
 None
 1.27A 3uvvB-5b3rA:
undetectable		 3uvvB-5b3rA:
24.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dm7 50S RIBOSOMAL
PROTEIN L20

(Deinococcus
radiodurans) 		PF00453
(Ribosomal_L20) 		5 ILE N  65
ALA N  67
LEU N  71
PHE N 106
ALA N 100
 None
 1.16A 3uvvB-5dm7N:
undetectable		 3uvvB-5dm7N:
16.94
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.
5e9a BETA-GALACTOSIDASE

(Rahnella sp. R3) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 ALA A 630
LEU A 642
ALA A 618
ILE A 389
LEU A 336
 None
 1.17A 3uvvB-5e9aA:
undetectable		 3uvvB-5e9aA:
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.
5fl3 PILI RETRACTION
PROTEIN PILT

(Thermus
thermophilus) 		PF00437
(T2SSE) 		5 ILE A 210
ALA A 227
ALA A 224
LEU A 135
ILE A 154
 None
 1.21A 3uvvB-5fl3A:
undetectable		 3uvvB-5fl3A:
24.12
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.
5i51 TRANSKETOLASE

(Scheffersomyces
stipitis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ILE A  12
ALA A  16
LEU A  32
ALA A  69
ILE A 222
 None
 1.10A 3uvvB-5i51A:
undetectable		 3uvvB-5i51A:
16.12
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.
5im5 DESIGNED
KETO-HYDROXYGLUTARAT
E-ALDOLASE/KETO-DEOX
Y-PHOSPHOGLUCONATE
ALDOLASE

(Vibrionales
bacterium
SWAT-3) 		no annotation 5 ILE P  53
ALA P  52
PHE P  44
ALA P  48
ILE P 105
 None
 1.26A 3uvvB-5im5P:
undetectable		 3uvvB-5im5P:
23.27
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.
5jr9 NEQ131

(Nanoarchaeum
equitans) 		PF01997
(Translin) 		5 ALA B  59
GLN B  62
LEU B  80
ILE B  37
LEU B  87
 None
 0.87A 3uvvB-5jr9B:
undetectable		 3uvvB-5jr9B:
21.26
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.
5lf9 NUCLEOSIDE
DIPHOSPHATE-LINKED
MOIETY X MOTIF 22

(Homo sapiens) 		no annotation 5 ALA A 279
ALA A 276
LEU A 272
VAL A 195
ILE A 252
 None
 1.31A 3uvvB-5lf9A:
undetectable		 3uvvB-5lf9A:
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.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 ILE A 752
ALA A 754
ALA A 755
ALA A 630
LEU A 762
 None
 1.22A 3uvvB-5mdnA:
undetectable		 3uvvB-5mdnA:
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.
5mux 2-METHYLCITRATE
DEHYDRATASE

(Bacillus
subtilis) 		no annotation 5 ILE A 112
ALA A 115
ALA A 116
LEU A 131
ILE A 141
 None
 1.08A 3uvvB-5muxA:
undetectable		 3uvvB-5muxA:
16.46
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.
5n6y NITROGENASE
VANADIUM-IRON
PROTEIN BETA CHAIN

(Azotobacter
vinelandii) 		no annotation 5 LEU E  49
VAL E 239
ILE E  43
CYH E  46
LEU E 106
 None
 0.83A 3uvvB-5n6yE:
undetectable		 3uvvB-5n6yE:
19.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 5 ALA A 271
ALA A 272
PHE A 313
ALA A 327
ILE A 428
 9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.4A)
None
 1.23A 3uvvB-5uanA:
34.4		 3uvvB-5uanA:
66.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 11 ILE A 268
ALA A 271
ALA A 272
GLN A 275
LEU A 309
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
LEU A 436
 9CR  A 503 (-4.0A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
9CR  A 503 (-3.7A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
None
9CR  A 503 ( 4.8A)
 0.55A 3uvvB-5uanA:
34.4		 3uvvB-5uanA:
66.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 10 ILE A 268
ALA A 271
GLN A 275
LEU A 309
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
 9CR  A 503 (-4.0A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
9CR  A 503 (-3.7A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
None
9CR  A 503 (-3.3A)
 0.70A 3uvvB-5uanA:
34.4		 3uvvB-5uanA:
66.30
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.
5xym 50S RIBOSOMAL
PROTEIN L22

(Mycolicibacterium
smegmatis) 		PF00237
(Ribosomal_L22) 		5 ILE S  58
ALA S  61
ALA S  62
LEU S  76
ILE S  42
 None
 0.66A 3uvvB-5xymS:
undetectable		 3uvvB-5xymS:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 5 ALA A  20
ALA A  21
ALA A 329
VAL A 126
ILE A 137
 None
 0.99A 3uvvB-6cmzA:
undetectable		 3uvvB-6cmzA:
26.15
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.
6d0n CLC-TYPE
FLUORIDE/PROTON
ANTIPORTER

(Enterococcus
casseliflavus) 		no annotation 5 ILE A 148
ALA A 152
ALA A 151
ALA A  28
LEU A 169
 None
 1.14A 3uvvB-6d0nA:
undetectable		 3uvvB-6d0nA:
19.58
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.
6d95 -

(-) 		no annotation 5 ILE A 129
ALA A 132
ALA A 133
ALA A 266
ILE A 180
 None
 0.98A 3uvvB-6d95A:
undetectable		 3uvvB-6d95A:
undetectable