SIMILAR PATTERNS OF AMINO ACIDS FOR 4XTA_A_DIFA501_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.
1ad3 ALDEHYDE
DEHYDROGENASE (CLASS
3)

(Rattus
norvegicus) 		PF00171
(Aldedh) 		4 ALA A  46
LEU A 149
LEU A 152
ILE A  36
 None
 0.70A 4xtaA-1ad3A:
0.0		 4xtaA-1ad3A:
21.32
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.
1ctt CYTIDINE DEAMINASE

(Escherichia
coli) 		PF00383
(dCMP_cyt_deam_1)
PF08211
(dCMP_cyt_deam_2) 		4 SER A 109
ALA A 111
LEU A 139
LEU A 145
 None
 0.94A 4xtaA-1cttA:
undetectable		 4xtaA-1cttA:
23.10
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.
1cu1 PROTEIN
(PROTEASE/HELICASE
NS3)

(Hepacivirus C) 		PF02907
(Peptidase_S29)
PF07652
(Flavi_DEAD) 		4 ALA A 157
LEU A 106
LEU A 143
ILE A 153
 None
 0.97A 4xtaA-1cu1A:
undetectable		 4xtaA-1cu1A:
17.52
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.
1cwu ENOYL ACP REDUCTASE

(Brassica napus) 		PF13561
(adh_short_C2) 		4 SER A 204
ALA A 207
GLU A 210
ILE A 194
 None
 0.51A 4xtaA-1cwuA:
undetectable		 4xtaA-1cwuA:
22.94
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.
1dbd REGULATORY PROTEIN
E2

(Deltapapillomavirus
4) 		PF00511
(PPV_E2_C) 		4 SER A  16
ALA A  96
LEU A  67
ILE A  68
 None
 1.00A 4xtaA-1dbdA:
undetectable		 4xtaA-1dbdA:
14.72
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.
1dc1 BSOBI RESTRICTION
ENDONUCLEASE

(Geobacillus
stearothermophilus) 		PF09194
(Endonuc-BsobI) 		4 SER A  54
ALA A  56
LEU A 114
LEU A  72
 None
 0.99A 4xtaA-1dc1A:
0.9		 4xtaA-1dc1A:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dqu ISOCITRATE LYASE

(Aspergillus
nidulans) 		PF00463
(ICL) 		4 ALA A 303
LEU A 275
LEU A 278
ILE A 295
 None
 0.94A 4xtaA-1dquA:
0.5		 4xtaA-1dquA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dxe 2-DEHYDRO-3-DEOXY-GA
LACTARATE ALDOLASE

(Escherichia
coli) 		PF03328
(HpcH_HpaI) 		4 ALA A 235
LEU A  96
LEU A 149
ILE A 173
 None
 0.89A 4xtaA-1dxeA:
0.0		 4xtaA-1dxeA:
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.
1ebl BETA-KETOACYL-ACP
SYNTHASE III

(Escherichia
coli) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 SER A 279
ALA A 283
GLU A 286
ILE A  39
 None
 0.97A 4xtaA-1eblA:
0.0		 4xtaA-1eblA:
21.32
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.
1fdj FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE

(Oryctolagus
cuniculus) 		PF00274
(Glycolytic) 		4 ALA A1309
LEU A1305
LEU A1030
ILE A1069
 None
 0.93A 4xtaA-1fdjA:
undetectable		 4xtaA-1fdjA:
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.
1fi4 MEVALONATE
5-DIPHOSPHATE
DECARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N) 		4 SER A 120
ALA A 123
LEU A  44
ILE A  14
 None
 0.87A 4xtaA-1fi4A:
undetectable		 4xtaA-1fi4A:
23.28
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.
1g71 DNA PRIMASE

(Pyrococcus
furiosus) 		PF01896
(DNA_primase_S) 		4 SER A 146
ALA A 305
LEU A 291
ILE A 152
 None
 0.96A 4xtaA-1g71A:
undetectable		 4xtaA-1g71A:
22.28
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.
1gnz GSI-B4 ISOLECTIN

(Griffonia
simplicifolia) 		PF00139
(Lectin_legB) 		4 SER A 219
ALA A  49
LEU A 110
ILE A 216
 None
 0.83A 4xtaA-1gnzA:
undetectable		 4xtaA-1gnzA:
20.20
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.
1h39 SQUALENE--HOPENE
CYCLASE

(Alicyclobacillus
acidocaldarius) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		4 ALA A 244
LEU A 275
LEU A 272
ILE A 270
 None
 0.94A 4xtaA-1h39A:
undetectable		 4xtaA-1h39A:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i36 CONSERVED
HYPOTHETICAL PROTEIN
MTH1747

(Methanothermobacter
thermautotrophicus) 		PF03807
(F420_oxidored)
PF09130
(DUF1932) 		4 ALA A 180
LEU A 173
LEU A 209
ILE A 206
 None
 0.99A 4xtaA-1i36A:
undetectable		 4xtaA-1i36A:
21.90
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.
1ivz HYPOTHETICAL PROTEIN
1110008I14RIK

(Mus musculus) 		PF01390
(SEA) 		4 CYH A  64
MET A 106
LEU A 113
ILE A  44
 None
 0.95A 4xtaA-1ivzA:
undetectable		 4xtaA-1ivzA:
18.45
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.
1jhs MOG1 PROTEIN

(Saccharomyces
cerevisiae) 		PF04603
(Mog1) 		4 GLU A 182
LEU A 123
LEU A 137
ILE A 156
 None
 0.93A 4xtaA-1jhsA:
undetectable		 4xtaA-1jhsA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k4q GLUTATHIONE
REDUCTASE

(Homo sapiens) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 GLU A 165
LEU A 261
LEU A 285
ILE A 175
 None
 0.87A 4xtaA-1k4qA:
undetectable		 4xtaA-1k4qA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ku2 SIGMA FACTOR SIGA

(Thermus
aquaticus) 		PF00140
(Sigma70_r1_2)
PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2) 		4 SER A 251
ALA A 254
LEU A 202
ILE A 115
 None
 0.82A 4xtaA-1ku2A:
undetectable		 4xtaA-1ku2A:
24.22
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.
1lgh LIGHT HARVESTING
COMPLEX II

(Phaeospirillum
molischianum) 		PF00556
(LHC) 		4 ALA B  15
LEU B   8
LEU A  11
ILE A   9
 LYC  A  97 ( 2.7A)
None
None
BCL  A  58 (-4.0A)
 0.85A 4xtaA-1lghB:
undetectable		 4xtaA-1lghB:
11.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lu2 LECTIN

(Vigna
unguiculata) 		PF00139
(Lectin_legB) 		4 SER A  76
ALA A  77
LEU A 156
ILE A  87
 None
 0.88A 4xtaA-1lu2A:
undetectable		 4xtaA-1lu2A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 SER A 260
ALA A 263
LEU A 287
ILE A 222
 IH5  A 600 ( 4.0A)
IH5  A 600 ( 3.8A)
None
IH5  A 600 (-4.3A)
 0.86A 4xtaA-1navA:
22.6		 4xtaA-1navA:
28.96
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.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 SER A 260
ALA A 263
LEU A 292
ILE A 222
 IH5  A 600 ( 4.0A)
IH5  A 600 ( 3.8A)
IH5  A 600 (-4.7A)
IH5  A 600 (-4.3A)
 0.97A 4xtaA-1navA:
22.6		 4xtaA-1navA:
28.96
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.
1ns3 NS3 PROTEASE

(Hepacivirus C) 		PF02907
(Peptidase_S29) 		4 ALA A 157
LEU A 106
LEU A 143
ILE A 153
 None
 0.91A 4xtaA-1ns3A:
undetectable		 4xtaA-1ns3A:
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.
1p4x STAPHYLOCOCCAL
ACCESSORY REGULATOR
A HOMOLOGUE

(Staphylococcus
aureus) 		no annotation 4 ALA A 228
GLU A 229
LEU A 204
ILE A 166
 None
 0.92A 4xtaA-1p4xA:
undetectable		 4xtaA-1p4xA:
24.22
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.
1peg HISTONE H3
METHYLTRANSFERASE
DIM-5

(Neurospora
crassa) 		PF00856
(SET)
PF05033
(Pre-SET) 		4 SER A  49
LEU A 208
LEU A 226
ILE A 183
 None
 0.95A 4xtaA-1pegA:
undetectable		 4xtaA-1pegA:
22.91
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.
1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Haemophilus
influenzae) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 SER A 166
ALA A 168
LEU A 176
LEU A 223
ILE A 271
 NAP  A1372 (-4.8A)
CYS  A1374 ( 4.8A)
None
None
None
 1.23A 4xtaA-1pquA:
undetectable		 4xtaA-1pquA:
22.94
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.
1prt PERTUSSIS TOXIN
(SUBUNIT S1)

(Bordetella
pertussis) 		PF02917
(Pertussis_S1) 		4 ALA A 206
GLU A 207
LEU A  64
ILE A  85
 None
 0.87A 4xtaA-1prtA:
undetectable		 4xtaA-1prtA:
17.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q18 GLUCOKINASE

(Escherichia
coli) 		PF02685
(Glucokinase) 		4 SER A 191
ALA A 135
LEU A 234
ILE A 218
 None
 0.95A 4xtaA-1q18A:
undetectable		 4xtaA-1q18A:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q4x THYROID HORMONE
RECEPTOR BETA-1

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 SER A 314
ALA A 317
LEU A 341
ILE A 276
 G24  A 462 ( 4.7A)
G24  A 462 ( 4.1A)
None
G24  A 462 ( 4.3A)
 0.89A 4xtaA-1q4xA:
23.2		 4xtaA-1q4xA:
28.17
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.
1q4x THYROID HORMONE
RECEPTOR BETA-1

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 SER A 314
ALA A 317
LEU A 346
ILE A 276
 G24  A 462 ( 4.7A)
G24  A 462 ( 4.1A)
G24  A 462 (-4.0A)
G24  A 462 ( 4.3A)
 0.97A 4xtaA-1q4xA:
23.2		 4xtaA-1q4xA:
28.17
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.
1qlm METHENYLTETRAHYDROME
THANOPTERIN
CYCLOHYDROLASE

(Methanopyrus
kandleri) 		PF02289
(MCH) 		4 CYH A  56
SER A 109
LEU A 166
ILE A 136
 None
 0.97A 4xtaA-1qlmA:
undetectable		 4xtaA-1qlmA:
21.08
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.
1r53 CHORISMATE SYNTHASE

(Saccharomyces
cerevisiae) 		PF01264
(Chorismate_synt) 		5 SER A 135
ALA A 137
GLU A 140
LEU A  43
ILE A 349
 None
 1.28A 4xtaA-1r53A:
undetectable		 4xtaA-1r53A:
22.05
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.
1sk7 HYPOTHETICAL PROTEIN
PA-HO

(Pseudomonas
aeruginosa) 		PF01126
(Heme_oxygenase) 		5 ALA A 110
GLU A 174
LEU A  68
LEU A  71
ILE A 164
 None
 1.45A 4xtaA-1sk7A:
undetectable		 4xtaA-1sk7A:
23.66
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.
1sxe TRANSCRIPTIONAL
REGULATOR ERG

(Homo sapiens) 		PF02198
(SAM_PNT) 		4 ALA A 146
GLU A 149
LEU A 192
LEU A 195
 None
 0.87A 4xtaA-1sxeA:
undetectable		 4xtaA-1sxeA:
17.78
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT
QUINOLINE
2-OXIDOREDUCTASE
SMALL SUBUNIT

(Pseudomonas
putida) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01799
(Fer2_2)
PF03450
(CO_deh_flav_C) 		4 CYH A  48
ALA A  32
LEU A  69
LEU C  37
 FES  A4908 (-2.4A)
None
None
None
 0.89A 4xtaA-1t3qA:
undetectable		 4xtaA-1t3qA:
18.31
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.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		4 ALA A 339
GLU A 338
LEU A 359
ILE A 379
 None
 0.90A 4xtaA-1tdjA:
undetectable		 4xtaA-1tdjA:
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.
1v33 DNA PRIMASE SMALL
SUBUNIT

(Pyrococcus
horikoshii) 		PF01896
(DNA_primase_S) 		4 SER A 146
ALA A 305
LEU A 291
ILE A 152
 PO4  A 701 ( 3.9A)
None
None
None
 0.86A 4xtaA-1v33A:
undetectable		 4xtaA-1v33A:
23.29
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.
1vq7 50S RIBOSOMAL
PROTEIN L30P

(Haloarcula
marismortui) 		PF00327
(Ribosomal_L30) 		4 CYH W  32
ALA W  70
LEU W  62
LEU W 100
 None
 0.99A 4xtaA-1vq7W:
undetectable		 4xtaA-1vq7W:
20.14
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.
1wao SERINE/THREONINE
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5) 		4 CYH 1 240
SER 1 447
ALA 1 459
LEU 1 256
 None
 0.96A 4xtaA-1wao1:
undetectable		 4xtaA-1wao1:
20.08
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.
1wrb DJVLGB

(Dugesia
japonica) 		PF00270
(DEAD) 		5 CYH A 227
SER A 377
ALA A 344
LEU A 392
ILE A 224
 None
 1.05A 4xtaA-1wrbA:
undetectable		 4xtaA-1wrbA:
22.79
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.
1wvg CDP-GLUCOSE
4,6-DEHYDRATASE

(Salmonella
enterica) 		PF16363
(GDP_Man_Dehyd) 		4 SER A  28
GLU A  33
LEU A 241
LEU A 238
 None
 0.72A 4xtaA-1wvgA:
undetectable		 4xtaA-1wvgA:
22.43
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.
1x0p HYPOTHETICAL PROTEIN
TLL0078

(Thermosynechococcus
elongatus) 		PF04940
(BLUF) 		4 SER A 110
ALA A 175
LEU A 106
ILE A 107
 FAD  A9150 ( 4.7A)
None
None
None
 0.95A 4xtaA-1x0pA:
undetectable		 4xtaA-1x0pA:
18.77
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.
1xb2 ELONGATION FACTOR
TS, MITOCHONDRIAL

(Bos taurus) 		PF00889
(EF_TS) 		4 CYH B 136
ALA B 202
LEU B 212
ILE B 211
 None
 0.92A 4xtaA-1xb2B:
undetectable		 4xtaA-1xb2B:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xkt FATTY ACID SYNTHASE

(Homo sapiens) 		PF00975
(Thioesterase) 		4 ALA A2305
LEU A2260
LEU A2485
ILE A2477
 None
 0.87A 4xtaA-1xktA:
undetectable		 4xtaA-1xktA:
22.63
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.
1yb5 QUINONE
OXIDOREDUCTASE

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 SER A  97
GLU A  51
LEU A 271
ILE A 129
 CL  A 818 (-4.7A)
None
NAP  A 801 (-4.8A)
None
 0.99A 4xtaA-1yb5A:
undetectable		 4xtaA-1yb5A:
21.33
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.
2a8q U8 SNORNA-BINDING
PROTEIN X29

(Xenopus laevis) 		PF00293
(NUDIX) 		4 SER A 207
ALA A 206
LEU A 169
ILE A 200
 YCM  A 174 ( 3.4A)
None
None
None
 0.99A 4xtaA-2a8qA:
undetectable		 4xtaA-2a8qA:
22.06
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.
2ah5 COG0546: PREDICTED
PHOSPHATASES

(Streptococcus
pneumoniae) 		PF13419
(HAD_2) 		4 SER A 132
ALA A 136
GLU A 135
ILE A 129
 None
 0.87A 4xtaA-2ah5A:
undetectable		 4xtaA-2ah5A:
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.
2ayz SENSOR KINASE
PROTEIN RCSC

(Escherichia
coli) 		PF00072
(Response_reg) 		4 SER A 874
ALA A 860
LEU A 897
ILE A 871
 None
 0.94A 4xtaA-2ayzA:
undetectable		 4xtaA-2ayzA:
23.08
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.
2bwp 5-AMINOLEVULINATE
SYNTHASE

(Rhodobacter
capsulatus) 		PF00155
(Aminotran_1_2) 		4 SER A 137
ALA A 183
LEU A 133
ILE A 134
 None
 0.89A 4xtaA-2bwpA:
undetectable		 4xtaA-2bwpA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cgj L-RHAMNULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 SER A 165
GLU A  57
LEU A 158
LEU A  89
 None
 0.87A 4xtaA-2cgjA:
undetectable		 4xtaA-2cgjA:
19.46
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.
2cvt RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE CHAIN 1

(Saccharomyces
cerevisiae) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 SER A 543
ALA A 546
GLU A 549
ILE A 473
 None
 0.89A 4xtaA-2cvtA:
undetectable		 4xtaA-2cvtA:
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.
2d9z PROTEIN KINASE C, NU
TYPE

(Homo sapiens) 		PF00169
(PH) 		4 ALA A 117
LEU A 122
LEU A  53
ILE A  51
 None
 0.95A 4xtaA-2d9zA:
undetectable		 4xtaA-2d9zA:
17.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e7j SEP-TRNA:CYS-TRNA
SYNTHASE

(Archaeoglobus
fulgidus) 		PF05889
(SepSecS) 		4 SER A 314
ALA A 317
LEU A 324
ILE A 367
 None
 0.96A 4xtaA-2e7jA:
undetectable		 4xtaA-2e7jA:
22.72
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.
2eam PUTATIVE 47 KDA
PROTEIN

(Homo sapiens) 		PF00536
(SAM_1) 		4 ALA A  69
LEU A  19
LEU A  24
ILE A  57
 None
 0.97A 4xtaA-2eamA:
undetectable		 4xtaA-2eamA:
18.18
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.
2fhe GLUTATHIONE
S-TRANSFERASE

(Fasciola
hepatica) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 GLU A 183
LEU A 175
LEU A 169
ILE A 161
 None
 0.98A 4xtaA-2fheA:
undetectable		 4xtaA-2fheA:
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.
2fi1 HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Streptococcus
pneumoniae) 		PF13419
(HAD_2) 		5 SER A  24
ALA A  27
GLU A  30
LEU A  78
ILE A  82
 None
 1.11A 4xtaA-2fi1A:
undetectable		 4xtaA-2fi1A:
24.29
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		4 SER A 273
ALA A 276
GLU A 279
ILE A 452
 None
 0.81A 4xtaA-2gljA:
undetectable		 4xtaA-2gljA:
21.79
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.
2gmg HYPOTHETICAL PROTEIN
PF0610

(Pyrococcus
furiosus) 		no annotation 4 SER A  53
ALA A  56
GLU A  59
ILE A  16
 None
 0.81A 4xtaA-2gmgA:
undetectable		 4xtaA-2gmgA:
17.94
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.
2gti REPLICASE
POLYPROTEIN 1AB

(Murine
coronavirus) 		PF06471
(NSP11) 		4 GLU A 295
LEU A 282
LEU A 279
ILE A 323
 None
 0.94A 4xtaA-2gtiA:
undetectable		 4xtaA-2gtiA:
23.00
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.
2hig 6-PHOSPHO-1-FRUCTOKI
NASE

(Trypanosoma
brucei) 		PF00365
(PFK) 		4 SER A 209
ALA A 212
LEU A  34
ILE A 192
 None
 0.86A 4xtaA-2higA:
undetectable		 4xtaA-2higA:
21.46
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.
2ido HOT PROTEIN

(Escherichia
virus P1) 		PF06440
(DNA_pol3_theta) 		4 SER B  24
ALA B  27
GLU B  30
LEU B  63
 None
 0.98A 4xtaA-2idoB:
undetectable		 4xtaA-2idoB:
17.58
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.
2ifd M-PHASE INDUCER
PHOSPHATASE 2

(Homo sapiens) 		PF00581
(Rhodanese) 		4 CYH A 426
ALA A 449
LEU A 469
ILE A 423
 None
 0.93A 4xtaA-2ifdA:
undetectable		 4xtaA-2ifdA:
24.26
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS) 		4 SER A  71
ALA A  74
GLU A  77
ILE A 140
 None
 0.86A 4xtaA-2incA:
1.5		 4xtaA-2incA:
20.69
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.
2mng POTASSIUM/SODIUM
HYPERPOLARIZATION-AC
TIVATED CYCLIC
NUCLEOTIDE-GATED
CHANNEL 4

(Homo sapiens) 		PF00027
(cNMP_binding) 		4 ALA A 591
MET A 607
LEU A 608
LEU A 611
 None
 0.92A 4xtaA-2mngA:
undetectable		 4xtaA-2mngA:
16.91
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.
2ovj RAC
GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF00620
(RhoGAP) 		4 ALA A 468
LEU A 429
LEU A 426
ILE A 365
 None
 0.93A 4xtaA-2ovjA:
undetectable		 4xtaA-2ovjA:
20.91
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.
2p3v INOSITOL-1-MONOPHOSP
HATASE

(Thermotoga
maritima) 		PF00459
(Inositol_P) 		5 SER A1095
ALA A1113
MET A1019
LEU A1018
ILE A1049
 None
 1.48A 4xtaA-2p3vA:
undetectable		 4xtaA-2p3vA:
19.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 SER A 280
GLU A 286
MET A 320
LEU A 321
 735  A 469 (-2.8A)
None
None
735  A 469 ( 4.3A)
 0.39A 4xtaA-2p54A:
35.1		 4xtaA-2p54A:
61.94
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.
2p6d DIPHTHINE SYNTHASE

(Pyrococcus
horikoshii) 		PF00590
(TP_methylase) 		4 GLU A  96
LEU A   3
LEU A  72
ILE A  70
 None
 0.95A 4xtaA-2p6dA:
undetectable		 4xtaA-2p6dA:
21.62
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.
2pbj PROSTAGLANDIN E
SYNTHASE 2

(Macaca
fascicularis) 		PF13417
(GST_N_3) 		4 ALA A 153
LEU A 125
LEU A 120
ILE A 169
 None
 0.93A 4xtaA-2pbjA:
undetectable		 4xtaA-2pbjA:
25.23
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.
2q09 IMIDAZOLONEPROPIONAS
E

(unidentified) 		PF01979
(Amidohydro_1) 		4 SER A 316
ALA A 331
LEU A  68
ILE A  69
 None
 0.86A 4xtaA-2q09A:
undetectable		 4xtaA-2q09A:
20.57
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.
2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE

(Homo sapiens) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 CYH A  29
ALA A  22
LEU A 313
LEU A  56
 None
 0.89A 4xtaA-2q50A:
undetectable		 4xtaA-2q50A:
25.98
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.
2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		4 SER A  25
LEU A  54
LEU A  57
ILE A  75
 None
 0.95A 4xtaA-2qfqA:
undetectable		 4xtaA-2qfqA:
22.20
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.
2qr6 IMP
DEHYDROGENASE/GMP
REDUCTASE

(Corynebacterium
glutamicum) 		PF00478
(IMPDH) 		4 ALA A  99
LEU A 112
LEU A 115
ILE A  93
 None
 0.94A 4xtaA-2qr6A:
undetectable		 4xtaA-2qr6A:
23.33
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.
2vhh CG3027-PA

(Drosophila
melanogaster) 		PF00795
(CN_hydrolase) 		4 CYH A 113
ALA A  44
LEU A 338
ILE A 105
 None
 0.94A 4xtaA-2vhhA:
undetectable		 4xtaA-2vhhA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vld UPF0286 PROTEIN
PYRAB01260

(Pyrococcus
abyssi) 		PF01939
(NucS) 		4 ALA A 184
LEU A 220
LEU A 225
ILE A 206
 None
 0.84A 4xtaA-2vldA:
undetectable		 4xtaA-2vldA:
24.74
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.
2w4i GLUTAMATE RACEMASE

(Helicobacter
pylori) 		PF01177
(Asp_Glu_race) 		4 SER A 210
ALA A 213
GLU A 216
LEU A 206
 None
 0.54A 4xtaA-2w4iA:
undetectable		 4xtaA-2w4iA:
23.79
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.
2wrt GLUTATHIONE
S-TRANSFERASE
CLASS-MU 26 KDA
ISOZYME 51

(Fasciola
hepatica) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 GLU A 184
LEU A 176
LEU A 170
ILE A 162
 None
 0.92A 4xtaA-2wrtA:
undetectable		 4xtaA-2wrtA:
21.96
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.
2wwx DRRA

(Legionella
pneumophila) 		no annotation 4 SER B 440
ALA B 372
LEU B 360
ILE B 365
 None
 0.92A 4xtaA-2wwxB:
0.5		 4xtaA-2wwxB:
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.
2x5f ASPARTATE_TYROSINE_P
HENYLALANINE
PYRIDOXAL-5'
PHOSPHATE-DEPENDENT
AMINOTRANSFERASE

(Staphylococcus
aureus) 		PF00155
(Aminotran_1_2) 		4 ALA A 220
LEU A 254
LEU A 251
ILE A 212
 None
 0.95A 4xtaA-2x5fA:
undetectable		 4xtaA-2x5fA:
20.59
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.
2xec PUTATIVE MALEATE
ISOMERASE

(Nocardia
farcinica) 		no annotation 4 SER A 111
ALA A 114
GLU A 117
ILE A   6
 None
 0.91A 4xtaA-2xecA:
undetectable		 4xtaA-2xecA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xec PUTATIVE MALEATE
ISOMERASE

(Nocardia
farcinica) 		no annotation 4 SER A 111
ALA A 114
GLU A 117
ILE A  72
 None
 0.75A 4xtaA-2xecA:
undetectable		 4xtaA-2xecA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xwu IMPORTIN13

(Homo sapiens) 		PF03810
(IBN_N)
PF08389
(Xpo1) 		5 SER B 268
ALA B 272
LEU B 315
LEU B 282
ILE B 263
 None
 1.48A 4xtaA-2xwuB:
undetectable		 4xtaA-2xwuB:
15.39
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.
2yq4 D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE

(Lactobacillus
delbrueckii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 SER A 229
ALA A 256
LEU A 119
ILE A 142
 None
 0.70A 4xtaA-2yq4A:
undetectable		 4xtaA-2yq4A:
24.18
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.
2z4r CHROMOSOMAL
REPLICATION
INITIATOR PROTEIN
DNAA

(Thermotoga
maritima) 		PF00308
(Bac_DnaA) 		4 ALA A 120
LEU A 147
LEU A 199
ILE A 230
 None
 0.97A 4xtaA-2z4rA:
undetectable		 4xtaA-2z4rA:
20.18
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.
2zyi LIPASE, PUTATIVE

(Archaeoglobus
fulgidus) 		PF00561
(Abhydrolase_1) 		4 ALA A 327
GLU A  39
LEU A 330
ILE A 467
 None
None
STE  A 500 ( 4.4A)
None
 0.91A 4xtaA-2zyiA:
undetectable		 4xtaA-2zyiA:
20.29
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 SER A  35
ALA A  56
LEU A  81
LEU A  84
 None
 0.89A 4xtaA-3a14A:
undetectable		 4xtaA-3a14A:
24.30
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.
3ajx 3-HEXULOSE-6-PHOSPHA
TE SYNTHASE

(Mycobacterium
gastri) 		PF00215
(OMPdecase) 		4 SER A1162
ALA A1180
LEU A1150
LEU A1147
 None
 0.92A 4xtaA-3ajxA:
undetectable		 4xtaA-3ajxA:
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.
3aq2 6B PROTEIN

(Agrobacterium
vitis) 		PF02027
(RolB_RolC) 		4 GLU A  69
LEU A 202
LEU A  15
ILE A  14
 None
 0.94A 4xtaA-3aq2A:
undetectable		 4xtaA-3aq2A:
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.
3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Chromohalobacter
salexigens) 		PF01370
(Epimerase) 		4 SER A  32
ALA A  10
LEU A   5
ILE A  67
 None
 0.90A 4xtaA-3ay3A:
undetectable		 4xtaA-3ay3A:
20.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 ALA A 292
GLU A 295
MET A 329
LEU A 330
LEU A 333
ILE A 341
 None
None
None
MC5  A   1 (-4.4A)
None
MC5  A   1 (-4.5A)
 0.43A 4xtaA-3b0qA:
37.9		 4xtaA-3b0qA:
98.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 CYH A 285
GLU A 295
MET A 329
LEU A 330
LEU A 333
ILE A 341
 MC5  A   1 (-3.6A)
None
None
MC5  A   1 (-4.4A)
None
MC5  A   1 (-4.5A)
 0.71A 4xtaA-3b0qA:
37.9		 4xtaA-3b0qA:
98.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 SER A 289
ALA A 292
GLU A 295
MET A 329
LEU A 330
LEU A 333
 MC5  A   1 (-2.6A)
None
None
None
MC5  A   1 (-4.4A)
None
 0.57A 4xtaA-3b0qA:
37.9		 4xtaA-3b0qA:
98.56
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.
3bhn THIJ/PFPI DOMAIN
PROTEIN

(Shewanella
loihica) 		PF01965
(DJ-1_PfpI) 		4 GLU A 199
LEU A 161
LEU A  95
ILE A  96
 None
None
EDO  A 218 (-4.3A)
None
 0.98A 4xtaA-3bhnA:
1.8		 4xtaA-3bhnA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cgw LPPG:FO
2-PHOSPHO-L-LACTATE
TRANSFERASE

(Methanosarcina
mazei) 		PF01933
(UPF0052) 		4 ALA A  94
LEU A 119
LEU A 116
ILE A 102
 None
 0.88A 4xtaA-3cgwA:
undetectable		 4xtaA-3cgwA:
22.78
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.
3d7i CARBOXYMUCONOLACTONE
DECARBOXYLASE FAMILY
PROTEIN

(Methanocaldococcus
jannaschii) 		PF02627
(CMD) 		5 SER A  66
ALA A  67
LEU A 104
LEU A 101
ILE A  60
 None
 1.45A 4xtaA-3d7iA:
undetectable		 4xtaA-3d7iA:
20.96
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.
3d8h GLYCOLYTIC
PHOSPHOGLYCERATE
MUTASE

(Cryptosporidium
parvum) 		PF00300
(His_Phos_1) 		4 SER A 122
ALA A 121
LEU A 115
LEU A 112
 None
 1.00A 4xtaA-3d8hA:
undetectable		 4xtaA-3d8hA:
22.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 CYH D 285
SER D 289
ALA D 292
GLU D 295
MET D 329
LEU D 330
LEU D 333
ILE D 341
 PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
None
None
PLB  D 701 ( 4.1A)
PLB  D 701 (-4.4A)
PLB  D 701 (-3.6A)
 0.62A 4xtaA-3dzuD:
34.8		 4xtaA-3dzuD:
91.45
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.
3e8s PUTATIVE SAM
DEPENDENT
METHYLTRANSFERASE

(Pseudomonas
putida) 		PF13489
(Methyltransf_23) 		4 SER A 190
ALA A 189
LEU A 219
ILE A 149
 None
 0.93A 4xtaA-3e8sA:
undetectable		 4xtaA-3e8sA:
23.26
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.
3f0n MEVALONATE
PYROPHOSPHATE
DECARBOXYLASE

(Mus musculus) 		PF00288
(GHMP_kinases_N) 		4 CYH A 160
SER A 149
LEU A  33
ILE A  32
 None
None
None
PO4  A 401 ( 4.6A)
 0.95A 4xtaA-3f0nA:
undetectable		 4xtaA-3f0nA:
20.28