SIMILAR PATTERNS OF AMINO ACIDS FOR 1GTN_R_TRPR81_0

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.
1fc9 PHOTOSYSTEM II D1
PROTEASE

(Tetradesmus
obliquus) 		PF03572
(Peptidase_S41)
PF13180
(PDZ_2) 		5 GLY A 431
ALA A 378
THR A 370
THR A 394
SER A 374
 None
 1.36A 1gtnR-1fc9A:
0.0
1gtnS-1fc9A:
0.0		 1gtnR-1fc9A:
12.11
1gtnS-1fc9A:
12.11
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.
1k7j PROTEIN YCIO

(Escherichia
coli) 		PF01300
(Sua5_yciO_yrdC) 		5 GLY A 120
THR A 182
THR A  98
ILE A 100
SER A 144
 None
None
SO4  A 207 ( 4.9A)
None
SO4  A 207 (-2.6A)
 1.48A 1gtnR-1k7jA:
0.0
1gtnS-1k7jA:
undetectable		 1gtnR-1k7jA:
18.93
1gtnS-1k7jA:
18.93
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 GLY A 412
ALA A 510
THR A 500
THR A 417
SER A 245
 None
None
None
TRA  A 866 (-4.0A)
TRA  A 866 (-2.6A)
 1.07A 1gtnR-1l5jA:
undetectable
1gtnS-1l5jA:
undetectable		 1gtnR-1l5jA:
7.07
1gtnS-1l5jA:
7.07
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.
1lzx NITRIC-OXIDE
SYNTHASE

(Rattus
norvegicus) 		PF02898
(NO_synthase) 		5 THR A 688
HIS A 652
THR A 655
ILE A 679
THR A 591
 None
 1.35A 1gtnR-1lzxA:
undetectable
1gtnS-1lzxA:
undetectable		 1gtnR-1lzxA:
10.02
1gtnS-1lzxA:
10.02
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.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		5 THR A 457
HIS A 421
THR A 424
ILE A 448
THR A 360
 None
 1.35A 1gtnR-1m9qA:
0.0
1gtnS-1m9qA:
0.0		 1gtnR-1m9qA:
9.88
1gtnS-1m9qA:
9.88
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.
1mio NITROGENASE
MOLYBDENUM IRON
PROTEIN (BETA CHAIN)

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		5 GLY B 156
ALA B 151
THR B 139
HIS B 103
THR B 137
 None
 1.24A 1gtnR-1mioB:
undetectable
1gtnS-1mioB:
undetectable		 1gtnR-1mioB:
9.76
1gtnS-1mioB:
9.76
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.
1n0w DNA REPAIR PROTEIN
RAD51 HOMOLOG 1

(Homo sapiens) 		PF08423
(Rad51) 		5 GLY A 116
ALA A 262
THR A 123
ILE A 102
SER A 121
 MG  A 401 (-3.8A)
None
None
None
None
 1.27A 1gtnR-1n0wA:
undetectable
1gtnS-1n0wA:
undetectable		 1gtnR-1n0wA:
14.40
1gtnS-1n0wA:
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.
1ps9 2,4-DIENOYL-COA
REDUCTASE

(Escherichia
coli) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		5 GLY A 248
THR A 272
THR A 247
ILE A 249
THR A 230
 None
 1.37A 1gtnR-1ps9A:
undetectable
1gtnS-1ps9A:
undetectable		 1gtnR-1ps9A:
8.10
1gtnS-1ps9A:
8.10
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.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT

(Thauera
aromatica) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 GLY A 284
HIS A 282
ALA A 312
THR A 351
THR A 679
 None
 1.48A 1gtnR-1sb3A:
undetectable
1gtnS-1sb3A:
0.0		 1gtnR-1sb3A:
7.84
1gtnS-1sb3A:
7.84
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.
1v1p EXOTOXIN 1

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		5 GLY A 203
THR A 112
THR A 114
ILE A 204
SER A 198
 None
 1.41A 1gtnR-1v1pA:
undetectable
1gtnS-1v1pA:
undetectable		 1gtnR-1v1pA:
19.02
1gtnS-1v1pA:
19.02
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.
1v7v CHITOBIOSE
PHOSPHORYLASE

(Vibrio
proteolyticus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 GLY A 419
HIS A 418
HIS A 385
THR A 423
ILE A 420
 None
 1.39A 1gtnR-1v7vA:
undetectable
1gtnS-1v7vA:
0.7		 1gtnR-1v7vA:
6.35
1gtnS-1v7vA:
6.35
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.
1vpx PROTEIN
(TRANSALDOLASE (EC
2.2.1.2))

(Thermotoga
maritima) 		PF00923
(TAL_FSA) 		5 GLY A  90
ALA A 121
THR A 104
ILE A  91
SER A  98
 None
 1.33A 1gtnR-1vpxA:
undetectable
1gtnS-1vpxA:
undetectable		 1gtnR-1vpxA:
18.53
1gtnS-1vpxA:
18.53
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		5 ALA A  23
HIS A 480
THR A 252
ILE A  13
SER A 495
 None
None
FAD  A 803 (-4.6A)
None
None
 1.42A 1gtnR-1yy5A:
undetectable
1gtnS-1yy5A:
undetectable		 1gtnR-1yy5A:
9.73
1gtnS-1yy5A:
9.73
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		5 GLY A  15
ALA A  23
THR A 252
ILE A  13
SER A 495
 FAD  A 803 (-3.2A)
None
FAD  A 803 (-4.6A)
None
None
 1.10A 1gtnR-1yy5A:
undetectable
1gtnS-1yy5A:
undetectable		 1gtnR-1yy5A:
9.73
1gtnS-1yy5A:
9.73
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.
1zbs HYPOTHETICAL PROTEIN
PG1100

(Porphyromonas
gingivalis) 		PF01869
(BcrAD_BadFG) 		5 GLY A  30
ALA A  44
THR A  28
ILE A  31
SER A  47
 None
 1.46A 1gtnR-1zbsA:
undetectable
1gtnS-1zbsA:
undetectable		 1gtnR-1zbsA:
12.33
1gtnS-1zbsA:
12.33
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.
1zwx SPHINGOMYELINASE-C

(Listeria
ivanovii) 		PF03372
(Exo_endo_phos) 		5 GLY A 183
THR A 186
HIS A 185
THR A 184
ILE A 182
 None
 1.32A 1gtnR-1zwxA:
undetectable
1gtnS-1zwxA:
undetectable		 1gtnR-1zwxA:
13.62
1gtnS-1zwxA:
13.62
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.
1zwx SPHINGOMYELINASE-C

(Listeria
ivanovii) 		PF03372
(Exo_endo_phos) 		5 GLY A 227
THR A 186
HIS A 185
THR A 184
ILE A 226
 None
 1.15A 1gtnR-1zwxA:
undetectable
1gtnS-1zwxA:
undetectable		 1gtnR-1zwxA:
13.62
1gtnS-1zwxA:
13.62
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.
2ag1 BENZALDEHYDE LYASE

(Pseudomonas
fluorescens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A  24
ALA A  56
HIS A  49
THR A  47
ILE A  45
 None
 1.38A 1gtnR-2ag1A:
undetectable
1gtnS-2ag1A:
undetectable		 1gtnR-2ag1A:
8.38
1gtnS-2ag1A:
8.38
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.
2ciy CHLOROPEROXIDASE

(Leptoxyphium
fumago) 		PF01328
(Peroxidase_2) 		5 GLY A  62
ALA A 189
HIS A 226
ILE A  63
SER A 192
 None
None
None
HEM  A 396 (-4.3A)
None
 1.35A 1gtnR-2ciyA:
undetectable
1gtnS-2ciyA:
undetectable		 1gtnR-2ciyA:
12.75
1gtnS-2ciyA:
12.75
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.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
SER A 817
 FAD  A1001 (-3.2A)
None
FAD  A1001 (-4.9A)
None
None
 0.99A 1gtnR-2dw4A:
undetectable
1gtnS-2dw4A:
undetectable		 1gtnR-2dw4A:
8.15
1gtnS-2dw4A:
8.15
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.
2eij CYTOCHROME C OXIDASE
SUBUNIT 1

(Bos taurus) 		PF00115
(COX1) 		5 GLY A 284
HIS A 240
ALA A 308
HIS A 291
ILE A 286
 None
CU  A 517 (-3.1A)
None
CU  A 517 ( 3.1A)
None
 1.36A 1gtnR-2eijA:
undetectable
1gtnS-2eijA:
undetectable		 1gtnR-2eijA:
9.53
1gtnS-2eijA:
9.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f1f ACETOLACTATE
SYNTHASE ISOZYME III
SMALL SUBUNIT

(Escherichia
coli) 		PF10369
(ALS_ss_C)
PF13710
(ACT_5) 		5 GLY A 154
THR A  34
THR A  47
ILE A   4
SER A 150
 None
 1.17A 1gtnR-2f1fA:
undetectable
1gtnS-2f1fA:
undetectable		 1gtnR-2f1fA:
20.48
1gtnS-2f1fA:
20.48
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		5 GLY B 677
ALA B 688
THR B 417
HIS B 682
ILE B 676
 None
None
None
NI  B 901 (-2.8A)
None
 1.00A 1gtnR-2fffB:
undetectable
1gtnS-2fffB:
undetectable		 1gtnR-2fffB:
11.03
1gtnS-2fffB:
11.03
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.
2gez L-ASPARAGINASE ALPHA
SUBUNIT
L-ASPARAGINASE BETA
SUBUNIT

(Lupinus luteus;
Lupinus luteus) 		PF01112
(Asparaginase_2)
PF01112
(Asparaginase_2) 		5 GLY B 195
HIS A   9
ALA A  67
THR B 225
THR B 209
 None
None
NA  A 401 (-4.6A)
None
None
 1.38A 1gtnR-2gezB:
undetectable
1gtnS-2gezB:
undetectable		 1gtnR-2gezB:
20.15
1gtnS-2gezB:
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.
2i3a N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 GLY A  23
HIS A  59
ALA A  87
HIS A  58
ILE A  25
 None
 0.83A 1gtnR-2i3aA:
undetectable
1gtnS-2i3aA:
undetectable		 1gtnR-2i3aA:
12.78
1gtnS-2i3aA:
12.78
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.
2p5u UDP-GLUCOSE
4-EPIMERASE

(Thermus
thermophilus) 		PF01370
(Epimerase) 		5 GLY A 299
ALA A 258
HIS A 306
THR A 303
ILE A 300
 None
 1.49A 1gtnR-2p5uA:
undetectable
1gtnS-2p5uA:
undetectable		 1gtnR-2p5uA:
12.68
1gtnS-2p5uA:
12.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q1y CELL DIVISION
PROTEIN FTSZ

(Mycobacterium
tuberculosis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A 107
ALA A  79
THR A  42
THR A 106
ILE A  16
 GSP  A 401 (-3.6A)
None
GSP  A 401 (-4.5A)
GSP  A 401 (-3.6A)
None
 1.37A 1gtnR-2q1yA:
undetectable
1gtnS-2q1yA:
undetectable		 1gtnR-2q1yA:
12.94
1gtnS-2q1yA:
12.94
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.
2qfv ISOCITRATE
DEHYDROGENASE [NADP]

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		5 GLY A 276
THR A 107
HIS A 134
ILE A 131
SER A 198
 None
 1.29A 1gtnR-2qfvA:
0.0
1gtnS-2qfvA:
undetectable		 1gtnR-2qfvA:
11.53
1gtnS-2qfvA:
11.53
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		5 ALA A 348
THR A 333
HIS A 334
THR A 361
ILE A 396
 None
None
ZN  A1566 (-3.5A)
None
None
 1.26A 1gtnR-2w9mA:
undetectable
1gtnS-2w9mA:
undetectable		 1gtnR-2w9mA:
8.00
1gtnS-2w9mA:
8.00
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.
2xzl ATP-DEPENDENT
HELICASE NAM7

(Saccharomyces
cerevisiae) 		PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 GLY A 435
ALA A 407
THR A 442
THR A 439
SER A 402
 ADP  A1854 (-3.1A)
ADP  A1854 ( 4.5A)
None
None
None
 1.23A 1gtnR-2xzlA:
undetectable
1gtnS-2xzlA:
undetectable		 1gtnR-2xzlA:
7.24
1gtnS-2xzlA:
7.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a1n NDP-SUGAR EPIMERASE

(Thermoplasma
volcanium) 		PF01370
(Epimerase) 		5 GLY A 166
THR A 178
THR A 179
THR A 112
SER A  74
 NAD  A3001 ( 4.6A)
None
NAD  A3001 ( 4.7A)
NAD  A3001 ( 4.5A)
None
 1.36A 1gtnR-3a1nA:
undetectable
1gtnS-3a1nA:
undetectable		 1gtnR-3a1nA:
13.02
1gtnS-3a1nA:
13.02
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.
3b9g IAG-NUCLEOSIDE
HYDROLASE

(Trypanosoma
vivax) 		PF01156
(IU_nuc_hydro) 		5 GLY A 166
ALA A 194
THR A 284
ILE A 187
THR A 295
 None
 1.07A 1gtnR-3b9gA:
undetectable
1gtnS-3b9gA:
undetectable		 1gtnR-3b9gA:
13.11
1gtnS-3b9gA:
13.11
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.
3cb5 FACT COMPLEX SUBUNIT
SPT16

(Schizosaccharomyces
pombe) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 ALA A 187
THR A 426
THR A 414
ILE A 184
SER A 191
 None
 0.91A 1gtnR-3cb5A:
undetectable
1gtnS-3cb5A:
undetectable		 1gtnR-3cb5A:
9.95
1gtnS-3cb5A:
9.95
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.
3e7d COBH, PRECORRIN-8X
METHYLMUTASE

(Brucella
abortus) 		PF02570
(CbiC) 		5 GLY A 111
ALA A 117
THR A 138
ILE A 110
SER A 115
 None
 1.29A 1gtnR-3e7dA:
undetectable
1gtnS-3e7dA:
undetectable		 1gtnR-3e7dA:
17.31
1gtnS-3e7dA:
17.31
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.
3ee4 PROBABLE
RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Mycobacterium
tuberculosis) 		PF00268
(Ribonuc_red_sm) 		5 GLY A 270
ALA A 238
THR A 267
ILE A 235
THR A 173
 None
None
None
None
MYR  A 315 ( 4.9A)
 1.42A 1gtnR-3ee4A:
undetectable
1gtnS-3ee4A:
undetectable		 1gtnR-3ee4A:
12.95
1gtnS-3ee4A:
12.95
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.
3eeg 2-ISOPROPYLMALATE
SYNTHASE

(Cytophaga
hutchinsonii) 		PF00682
(HMGL-like) 		5 GLY A 208
ALA A 212
THR A 239
HIS A 204
SER A 214
 None
 1.32A 1gtnR-3eegA:
undetectable
1gtnS-3eegA:
undetectable		 1gtnR-3eegA:
17.23
1gtnS-3eegA:
17.23
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN

(Geobacillus
kaustophilus) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 ALA A 389
THR A 349
HIS A 348
ILE A 364
SER A 385
 None
None
MG  A   7 (-3.6A)
None
None
 1.44A 1gtnR-3f2bA:
undetectable
1gtnS-3f2bA:
undetectable		 1gtnR-3f2bA:
6.36
1gtnS-3f2bA:
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.
3hpa AMIDOHYDROLASE

(unidentified) 		PF01979
(Amidohydro_1) 		5 GLY A 174
ALA A 140
THR A 457
ILE A 173
THR A 442
 None
 1.19A 1gtnR-3hpaA:
undetectable
1gtnS-3hpaA:
undetectable		 1gtnR-3hpaA:
10.65
1gtnS-3hpaA:
10.65
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.
3jsk CYPBP37 PROTEIN

(Neurospora
crassa) 		PF01946
(Thi4) 		5 GLY A  86
ALA A  94
THR A 246
ILE A  84
SER A 322
 AHZ  A 500 (-3.0A)
None
None
None
None
 1.24A 1gtnR-3jskA:
undetectable
1gtnS-3jskA:
undetectable		 1gtnR-3jskA:
13.37
1gtnS-3jskA:
13.37
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.
3k55 BETA-HEMOLYSIN

(Staphylococcus
aureus) 		PF03372
(Exo_endo_phos) 		5 GLY A 192
THR A 151
HIS A 150
THR A 149
ILE A 191
 None
 1.11A 1gtnR-3k55A:
undetectable
1gtnS-3k55A:
undetectable		 1gtnR-3k55A:
13.73
1gtnS-3k55A:
13.73
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.
3k5h PHOSPHORIBOSYL-AMINO
IMIDAZOLE
CARBOXYLASE

(Aspergillus
clavatus) 		PF01262
(AlaDh_PNT_C)
PF02222
(ATP-grasp) 		5 GLY A 282
ALA A 221
HIS A 277
ILE A 307
THR A 358
 None
 1.22A 1gtnR-3k5hA:
undetectable
1gtnS-3k5hA:
undetectable		 1gtnR-3k5hA:
11.53
1gtnS-3k5hA:
11.53
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.
3kto RESPONSE REGULATOR
RECEIVER PROTEIN

(Pseudoalteromonas
atlantica) 		PF00072
(Response_reg) 		5 GLY A  58
ALA A 109
HIS A  85
ILE A 128
SER A 107
 None
 1.17A 1gtnR-3ktoA:
undetectable
1gtnS-3ktoA:
undetectable		 1gtnR-3ktoA:
18.94
1gtnS-3ktoA:
18.94
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.
3l4g PHENYLALANYL-TRNA
SYNTHETASE ALPHA
CHAIN

(Homo sapiens) 		PF01409
(tRNA-synt_2d) 		5 GLY A 458
THR A 328
HIS A 327
ILE A 373
SER A 332
 PHE  A 509 (-3.6A)
None
None
None
None
 1.45A 1gtnR-3l4gA:
undetectable
1gtnS-3l4gA:
undetectable		 1gtnR-3l4gA:
9.81
1gtnS-3l4gA:
9.81
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.
3l6c SERINE RACEMASE

(Rattus
norvegicus) 		PF00291
(PALP) 		5 GLY A  88
HIS A  87
ALA A 102
THR A  81
ILE A 104
 None
 1.14A 1gtnR-3l6cA:
undetectable
1gtnS-3l6cA:
undetectable		 1gtnR-3l6cA:
14.11
1gtnS-3l6cA:
14.11
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.
3l6r SERINE RACEMASE

(Homo sapiens) 		PF00291
(PALP) 		5 GLY A  88
HIS A  87
ALA A 102
THR A  81
ILE A 104
 None
 1.15A 1gtnR-3l6rA:
undetectable
1gtnS-3l6rA:
undetectable		 1gtnR-3l6rA:
12.84
1gtnS-3l6rA:
12.84
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.
3rwb PYRIDOXAL
4-DEHYDROGENASE

(Mesorhizobium
loti) 		PF13561
(adh_short_C2) 		5 GLY A 160
ALA A 140
THR A 116
THR A 165
SER A 138
 None
 1.23A 1gtnR-3rwbA:
undetectable
1gtnS-3rwbA:
undetectable		 1gtnR-3rwbA:
16.06
1gtnS-3rwbA:
16.06
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.
3tqo CYSTEINYL-TRNA
SYNTHETASE

(Coxiella
burnetii) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		5 HIS A 235
ALA A 212
HIS A 236
ILE A 208
SER A 214
 ZN  A 461 (-3.4A)
None
None
None
None
 1.21A 1gtnR-3tqoA:
undetectable
1gtnS-3tqoA:
undetectable		 1gtnR-3tqoA:
10.75
1gtnS-3tqoA:
10.75
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.
3txx PUTRESCINE
CARBAMOYLTRANSFERASE

(Enterococcus
faecalis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 GLY A 124
HIS A 130
THR A 132
ILE A 122
SER A  58
 None
 1.22A 1gtnR-3txxA:
undetectable
1gtnS-3txxA:
undetectable		 1gtnR-3txxA:
11.21
1gtnS-3txxA:
11.21
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.
3v4b STARVATION SENSING
PROTEIN RSPA

(Cellvibrio
japonicus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 261
THR A 285
HIS A 288
THR A 284
ILE A 282
 None
 1.48A 1gtnR-3v4bA:
undetectable
1gtnS-3v4bA:
undetectable		 1gtnR-3v4bA:
12.60
1gtnS-3v4bA:
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.
3wpe TOLL-LIKE RECEPTOR 9

(Bos taurus) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 GLY A 133
HIS A 151
THR A 152
ILE A 134
SER A 148
 None
 1.18A 1gtnR-3wpeA:
undetectable
1gtnS-3wpeA:
undetectable		 1gtnR-3wpeA:
7.17
1gtnS-3wpeA:
7.17
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.
3x0y DSZC

(Rhodococcus
erythropolis) 		PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		5 GLY A 209
HIS A 388
THR A 387
ILE A 208
THR A 213
 None
FMN  A 500 (-4.6A)
None
None
FMN  A 500 ( 4.6A)
 1.14A 1gtnR-3x0yA:
undetectable
1gtnS-3x0yA:
undetectable		 1gtnR-3x0yA:
11.36
1gtnS-3x0yA:
11.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zte TRYPTOPHAN OPERON
RNA-BINDING
ATTENUATION PROTEIN
(TRAP)

(Bacillus
licheniformis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  33
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A  80 (-3.5A)
None
TRP  A  80 (-2.8A)
None
TRP  A  80 (-3.6A)
TRP  A  80 ( 4.6A)
 0.42A 1gtnR-3zteA:
14.2
1gtnS-3zteA:
14.1		 1gtnR-3zteA:
78.21
1gtnS-3zteA:
78.21
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.
3zyv AOX3

(Mus musculus) 		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 GLY A  50
THR A  56
THR A  75
ILE A 349
SER A 127
 FES  A3002 ( 3.1A)
None
FES  A3002 ( 4.3A)
FAD  A3005 ( 4.3A)
None
 1.44A 1gtnR-3zyvA:
undetectable
1gtnS-3zyvA:
undetectable		 1gtnR-3zyvA:
4.62
1gtnS-3zyvA:
4.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  33
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A  81 (-3.5A)
None
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
 0.42A 1gtnR-3zzlA:
12.9
1gtnS-3zzlA:
13.0		 1gtnR-3zzlA:
71.43
1gtnS-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  33
ALA A  46
THR A  49
THR A  52
ILE A  55
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 4.4A)
 0.30A 1gtnR-3zzqA:
13.5
1gtnS-3zzqA:
13.4		 1gtnR-3zzqA:
80.00
1gtnS-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  33
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A1072 (-3.5A)
None
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
TRP  A1072 ( 4.4A)
 0.33A 1gtnR-3zzsA:
13.4
1gtnS-3zzsA:
13.3		 1gtnR-3zzsA:
100.00
1gtnS-3zzsA:
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.
4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E

(Streptomyces
cinnabarigriseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 228
HIS A 313
THR A 318
THR A 314
SER A 322
 NAP  A1447 (-3.2A)
NAP  A1447 (-4.3A)
None
NAP  A1447 (-4.6A)
None
 1.34A 1gtnR-4a0sA:
undetectable
1gtnS-4a0sA:
undetectable		 1gtnR-4a0sA:
10.76
1gtnS-4a0sA:
10.76
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.
4aj9 CATALASE-3

(Neurospora
crassa) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 ALA A 320
THR A 377
HIS A 249
THR A 250
ILE A 315
 None
None
HEM  A1715 (-3.9A)
None
None
 1.29A 1gtnR-4aj9A:
undetectable
1gtnS-4aj9A:
undetectable		 1gtnR-4aj9A:
8.76
1gtnS-4aj9A:
8.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  33
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 GLY  A  23 (-0.0A)
HIS  A  33 ( 1.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
ILE  A  55 ( 0.6A)
 0.40A 1gtnR-4b27A:
13.1
1gtnS-4b27A:
13.0		 1gtnR-4b27A:
76.32
1gtnS-4b27A:
76.32
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.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		5 ALA A 500
THR A 572
THR A 545
ILE A 547
SER A 504
 None
 1.24A 1gtnR-4bx9A:
undetectable
1gtnS-4bx9A:
undetectable		 1gtnR-4bx9A:
7.91
1gtnS-4bx9A:
7.91
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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		5 GLY A 124
HIS A 123
ALA A 138
THR A 117
ILE A 140
 None
 1.10A 1gtnR-4d9iA:
undetectable
1gtnS-4d9iA:
undetectable		 1gtnR-4d9iA:
11.42
1gtnS-4d9iA:
11.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e6e CELL DIVISION
PROTEIN FTSZ

(Thermobifida
fusca) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A 107
ALA A  79
THR A  42
THR A 106
ILE A  16
 SO4  A 607 (-3.4A)
None
None
SO4  A 607 (-4.3A)
None
 1.27A 1gtnR-4e6eA:
undetectable
1gtnS-4e6eA:
undetectable		 1gtnR-4e6eA:
12.06
1gtnS-4e6eA:
12.06
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.
4fc7 PEROXISOMAL
2,4-DIENOYL-COA
REDUCTASE

(Homo sapiens) 		PF13561
(adh_short_C2) 		5 ALA A  69
HIS A  54
THR A  55
ILE A  57
THR A  76
 None
 1.21A 1gtnR-4fc7A:
undetectable
1gtnS-4fc7A:
undetectable		 1gtnR-4fc7A:
16.60
1gtnS-4fc7A:
16.60
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.
4fqd NIKO PROTEIN

(Streptomyces
tendae) 		PF00275
(EPSP_synthase) 		5 GLY A 203
ALA A 233
HIS A 207
ILE A 245
SER A 252
 None
 1.07A 1gtnR-4fqdA:
undetectable
1gtnS-4fqdA:
undetectable		 1gtnR-4fqdA:
9.50
1gtnS-4fqdA:
9.50
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 GLY A 389
ALA A 397
THR A 626
ILE A 387
SER A 811
 FAD  A 901 (-3.3A)
None
None
None
None
 1.05A 1gtnR-4hsuA:
undetectable
1gtnS-4hsuA:
undetectable		 1gtnR-4hsuA:
7.64
1gtnS-4hsuA:
7.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 GLY B 191
THR B 340
THR B 339
ILE B 194
THR B 169
 None
 1.01A 1gtnR-4i6mB:
undetectable
1gtnS-4i6mB:
undetectable		 1gtnR-4i6mB:
11.93
1gtnS-4i6mB:
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.
4kpo NUCLEOSIDE
N-RIBOHYDROLASE 3

(Zea mays) 		PF01156
(IU_nuc_hydro) 		5 HIS A  66
ALA A 103
THR A  44
THR A  40
ILE A  34
 None
 1.24A 1gtnR-4kpoA:
undetectable
1gtnS-4kpoA:
undetectable		 1gtnR-4kpoA:
15.07
1gtnS-4kpoA:
15.07
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.
4m8d PUTATIVE
UNCHARACTERIZED
PROTEIN

(Labrenzia
aggregata) 		PF04199
(Cyclase) 		5 GLY A 251
HIS A  73
THR A 250
ILE A 246
THR A  45
 None
MN  A 301 ( 3.3A)
None
None
None
 1.49A 1gtnR-4m8dA:
undetectable
1gtnS-4m8dA:
undetectable		 1gtnR-4m8dA:
14.45
1gtnS-4m8dA:
14.45
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.
4ov4 2-ISOPROPYLMALATE
SYNTHASE

(Leptospira
biflexa) 		PF00682
(HMGL-like) 		5 GLY A 213
ALA A 217
THR A 244
HIS A 209
SER A 219
 None
None
None
ZN  A 401 ( 3.4A)
None
 1.16A 1gtnR-4ov4A:
undetectable
1gtnS-4ov4A:
undetectable		 1gtnR-4ov4A:
11.11
1gtnS-4ov4A:
11.11
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.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		5 GLY A  84
ALA A  71
HIS A 119
THR A 115
THR A  87
 None
 1.30A 1gtnR-4q0gA:
undetectable
1gtnS-4q0gA:
undetectable		 1gtnR-4q0gA:
9.33
1gtnS-4q0gA:
9.33
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.
4s28 PHOSPHOMETHYLPYRIMID
INE SYNTHASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01964
(ThiC_Rad_SAM) 		5 GLY A 470
THR A 456
HIS A 426
THR A 455
ILE A 469
 None
None
FE2  A 704 ( 3.4A)
None
None
 1.43A 1gtnR-4s28A:
undetectable
1gtnS-4s28A:
undetectable		 1gtnR-4s28A:
9.41
1gtnS-4s28A:
9.41
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.
4ure CYCLOHEXANOL
DEHYDROGENASE

(Aromatoleum
aromaticum) 		PF13561
(adh_short_C2) 		5 GLY A 117
HIS A  69
ALA A  90
THR A  63
ILE A 113
 None
 1.35A 1gtnR-4ureA:
undetectable
1gtnS-4ureA:
undetectable		 1gtnR-4ureA:
17.32
1gtnS-4ureA:
17.32
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.
4xf7 CARBOHYDRATE/PYRIMID
INE KINASE, PFKB
FAMILY

(Thermococcus
kodakarensis) 		no annotation 5 GLY A   7
THR A  45
ILE A  96
THR A  73
SER A  69
 None
 1.42A 1gtnR-4xf7A:
undetectable
1gtnS-4xf7A:
undetectable		 1gtnR-4xf7A:
15.20
1gtnS-4xf7A:
15.20
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.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		5 GLY A 164
ALA A 144
THR A 115
THR A 169
SER A 142
 None
 1.17A 1gtnR-4xgnA:
undetectable
1gtnS-4xgnA:
undetectable		 1gtnR-4xgnA:
13.85
1gtnS-4xgnA:
13.85
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.
4yji ARYL ACYLAMIDASE

(bacterium
CSBL00001) 		PF01425
(Amidase) 		5 GLY A 162
ALA A 167
THR A 150
THR A 142
THR A 195
 None
 1.11A 1gtnR-4yjiA:
undetectable
1gtnS-4yjiA:
undetectable		 1gtnR-4yjiA:
9.31
1gtnS-4yjiA:
9.31
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.
5dx5 METHIONINE
GAMMA-LYASE

(Clostridium
sporogenes) 		PF01053
(Cys_Met_Meta_PP) 		5 GLY A 245
ALA A  85
THR A 244
ILE A 240
SER A  87
 None
None
None
None
PLP  A 501 (-3.7A)
 1.31A 1gtnR-5dx5A:
undetectable
1gtnS-5dx5A:
undetectable		 1gtnR-5dx5A:
11.50
1gtnS-5dx5A:
11.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  33
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 None
 0.37A 1gtnR-5eexA:
15.3
1gtnS-5eexA:
15.2		 1gtnR-5eexA:
100.00
1gtnS-5eexA:
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.
5f9p ANTHRONE
OXIDASE-LIKE PROTEIN

(Streptomyces
ambofaciens) 		PF03992
(ABM) 		5 GLY A 117
HIS A 226
THR A  48
ILE A 116
SER A 229
 None
 1.31A 1gtnR-5f9pA:
undetectable
1gtnS-5f9pA:
undetectable		 1gtnR-5f9pA:
15.35
1gtnS-5f9pA:
15.35
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.
5i6c URIC ACID-XANTHINE
PERMEASE

(Aspergillus
nidulans) 		PF00860
(Xan_ur_permease) 		5 GLY A 359
ALA A 384
THR A 405
THR A 364
SER A 149
 LMT  A1002 ( 3.9A)
None
None
None
None
 1.38A 1gtnR-5i6cA:
undetectable
1gtnS-5i6cA:
undetectable		 1gtnR-5i6cA:
8.03
1gtnS-5i6cA:
8.03
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.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 ALA A 293
HIS A 802
THR A 624
ILE A 283
SER A 817
 None
 1.36A 1gtnR-5l3dA:
undetectable
1gtnS-5l3dA:
undetectable		 1gtnR-5l3dA:
6.27
1gtnS-5l3dA:
6.27
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.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 285
ALA A 293
THR A 624
ILE A 283
SER A 817
 FAD  A 901 (-3.3A)
None
None
None
None
 1.03A 1gtnR-5l3dA:
undetectable
1gtnS-5l3dA:
undetectable		 1gtnR-5l3dA:
6.27
1gtnS-5l3dA:
6.27
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.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		5 GLY A  80
THR A 199
HIS A  77
THR A  54
ILE A 118
 None
 1.06A 1gtnR-5lgcA:
undetectable
1gtnS-5lgcA:
undetectable		 1gtnR-5lgcA:
17.89
1gtnS-5lgcA:
17.89
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.
5nnn CTATC

(Chaetomium
thermophilum) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 GLY A2074
HIS A2081
THR A2083
ILE A2072
SER A2008
 None
 1.19A 1gtnR-5nnnA:
undetectable
1gtnS-5nnnA:
undetectable		 1gtnR-5nnnA:
15.08
1gtnS-5nnnA:
15.08
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.
5o1m RUBBER OXYGENASE

(Streptomyces
sp. K30) 		PF09995
(DUF2236) 		5 GLY A 172
ALA A 180
THR A 190
ILE A 175
SER A 186
 None
 1.17A 1gtnR-5o1mA:
undetectable
1gtnS-5o1mA:
undetectable		 1gtnR-5o1mA:
12.64
1gtnS-5o1mA:
12.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uju NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		5 ALA A 144
THR A 136
THR A 137
THR A 210
SER A 132
 None
 1.47A 1gtnR-5ujuA:
undetectable
1gtnS-5ujuA:
undetectable		 1gtnR-5ujuA:
8.35
1gtnS-5ujuA:
8.35
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.
5y6q ALDEHYDE OXIDASE
LARGE SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 5 GLY C  65
ALA C 278
HIS C 271
ILE C 138
SER C 276
 None
 1.31A 1gtnR-5y6qC:
undetectable
1gtnS-5y6qC:
undetectable		 1gtnR-5y6qC:
undetectable
1gtnS-5y6qC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y6r GENOME POLYPROTEIN

(Pestivirus C) 		no annotation 5 GLY A 147
ALA A 622
HIS A 626
THR A 627
ILE A 148
 SO4  A 706 ( 4.4A)
None
SO4  A 706 (-3.9A)
None
None
 1.19A 1gtnR-5y6rA:
undetectable
1gtnS-5y6rA:
undetectable		 1gtnR-5y6rA:
undetectable
1gtnS-5y6rA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y6r GENOME POLYPROTEIN

(Pestivirus C) 		no annotation 5 GLY A 147
ALA A 622
THR A 627
ILE A 148
SER A 618
 SO4  A 706 ( 4.4A)
None
None
None
None
 1.39A 1gtnR-5y6rA:
undetectable
1gtnS-5y6rA:
undetectable		 1gtnR-5y6rA:
undetectable
1gtnS-5y6rA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ygr DIAMINOPROPIONATE
AMMONIA LYASE

(Salmonella
enterica) 		no annotation 5 GLY A 126
ALA A 133
THR A 122
THR A 124
ILE A 159
 PO4  A 504 (-4.5A)
None
None
PO4  A 504 (-3.6A)
None
 1.11A 1gtnR-5ygrA:
undetectable
1gtnS-5ygrA:
undetectable		 1gtnR-5ygrA:
undetectable
1gtnS-5ygrA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z73 ALR0819 PROTEIN

(Nostoc sp. PCC
7120) 		no annotation 5 GLY A  34
ALA A  60
THR A  35
ILE A  71
SER A  58
 None
 1.29A 1gtnR-5z73A:
undetectable
1gtnS-5z73A:
undetectable		 1gtnR-5z73A:
undetectable
1gtnS-5z73A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 5 GLY A 134
HIS A 152
THR A 153
ILE A 135
SER A 149
 None
 1.12A 1gtnR-5zlnA:
undetectable
1gtnS-5zlnA:
undetectable		 1gtnR-5zlnA:
undetectable
1gtnS-5zlnA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6geb DOTB

(Legionella
pneumophila) 		no annotation 5 GLY A 150
ALA A 245
THR A 290
ILE A 151
THR A 251
 None
 1.20A 1gtnR-6gebA:
undetectable
1gtnS-6gebA:
undetectable		 1gtnR-6gebA:
undetectable
1gtnS-6gebA:
undetectable