SIMILAR PATTERNS OF AMINO ACIDS FOR 1GTN_O_TRPO81_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
 1.35A 1gtnO-1fc9A:
0.0
1gtnP-1fc9A:
undetectable		 1gtnO-1fc9A:
12.11
1gtnP-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.
1hr7 MITOCHONDRIAL
PROCESSING PEPTIDASE
BETA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 GLY B  67
ALA B  60
THR B  68
THR B 103
ALA B  56
 None
 1.46A 1gtnO-1hr7B:
undetectable
1gtnP-1hr7B:
undetectable		 1gtnO-1hr7B:
9.26
1gtnP-1hr7B:
9.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ka0 HALOTOLERANCE
PROTEIN HAL2

(Saccharomyces
cerevisiae) 		PF00459
(Inositol_P) 		5 GLY A 306
HIS A 303
ALA A 206
HIS A 309
ALA A 200
 None
 1.11A 1gtnO-1ka0A:
0.0
1gtnP-1ka0A:
0.0		 1gtnO-1ka0A:
12.32
1gtnP-1ka0A:
12.32
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.
1kht ADENYLATE KINASE

(Methanococcus
voltae) 		PF13207
(AAA_17) 		5 GLY A  10
HIS A 151
ALA A 159
THR A   9
ALA A 158
 None
 1.45A 1gtnO-1khtA:
undetectable
1gtnP-1khtA:
undetectable		 1gtnO-1khtA:
15.71
1gtnP-1khtA:
15.71
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 GLY A 264
HIS A 131
THR A 259
SER A 389
ALA A 388
 None
None
CL  A 541 (-3.9A)
FAD  A 800 (-4.3A)
None
 1.19A 1gtnO-1knrA:
undetectable
1gtnP-1knrA:
undetectable		 1gtnO-1knrA:
9.07
1gtnP-1knrA:
9.07
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 GLY A 264
THR A 119
THR A 259
SER A 389
ALA A 388
 None
None
CL  A 541 (-3.9A)
FAD  A 800 (-4.3A)
None
 1.24A 1gtnO-1knrA:
undetectable
1gtnP-1knrA:
undetectable		 1gtnO-1knrA:
9.07
1gtnP-1knrA:
9.07
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.
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)
 1.13A 1gtnO-1l5jA:
undetectable
1gtnP-1l5jA:
undetectable		 1gtnO-1l5jA:
7.07
1gtnP-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.
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
 1.28A 1gtnO-1mioB:
undetectable
1gtnP-1mioB:
undetectable		 1gtnO-1mioB:
9.76
1gtnP-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.
1olp ALPHA-TOXIN

(Clostridium
sardiniense) 		PF00882
(Zn_dep_PLPC)
PF01477
(PLAT) 		5 GLY A 226
ALA A 221
THR A 133
THR A  10
ALA A 155
 None
 1.29A 1gtnO-1olpA:
3.3
1gtnP-1olpA:
3.3		 1gtnO-1olpA:
11.35
1gtnP-1olpA:
11.35
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.
1vgm 378AA LONG
HYPOTHETICAL CITRATE
SYNTHASE

(Sulfurisphaera
tokodaii) 		PF00285
(Citrate_synt) 		5 HIS A 219
ALA A 223
THR A 313
HIS A 184
ALA A 222
 SO4  A 411 ( 3.8A)
GOL  A 401 (-3.1A)
None
None
GOL  A 401 (-3.2A)
 1.46A 1gtnO-1vgmA:
undetectable
1gtnP-1vgmA:
undetectable		 1gtnO-1vgmA:
11.76
1gtnP-1vgmA:
11.76
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.
1vhx PUTATIVE HOLLIDAY
JUNCTION RESOLVASE

(Bacillus
subtilis) 		PF03652
(RuvX) 		5 GLY A   9
ALA A 125
THR A  30
THR A  12
ALA A 126
 None
 1.29A 1gtnO-1vhxA:
undetectable
1gtnP-1vhxA:
undetectable		 1gtnO-1vhxA:
20.41
1gtnP-1vhxA:
20.41
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.
1xr4 PUTATIVE CITRATE
LYASE ALPHA
CHAIN/CITRATE-ACP
TRANSFERASE

(Salmonella
enterica) 		PF04223
(CitF) 		5 GLY A 273
ALA A 280
THR A 272
THR A 406
ALA A 251
 None
 1.25A 1gtnO-1xr4A:
undetectable
1gtnP-1xr4A:
undetectable		 1gtnO-1xr4A:
11.26
1gtnP-1xr4A:
11.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zbr CONSERVED
HYPOTHETICAL PROTEIN

(Porphyromonas
gingivalis) 		PF04371
(PAD_porph) 		5 GLY A 326
HIS A 325
ALA A 275
THR A 211
HIS A 208
 None
 1.34A 1gtnO-1zbrA:
undetectable
1gtnP-1zbrA:
undetectable		 1gtnO-1zbrA:
11.24
1gtnP-1zbrA:
11.24
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.
2b4z CYTOCHROME C

(Bos taurus) 		PF00034
(Cytochrom_C) 		5 GLY A  24
HIS A  33
HIS A  18
THR A  19
ALA A 101
 None
None
HEM  A 500 (-3.3A)
None
None
 1.40A 1gtnO-2b4zA:
undetectable
1gtnP-2b4zA:
undetectable		 1gtnO-2b4zA:
22.33
1gtnP-2b4zA:
22.33
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.
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
 1.40A 1gtnO-2gezB:
undetectable
1gtnP-2gezB:
undetectable		 1gtnO-2gezB:
20.15
1gtnP-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.
2h32 IMMUNOGLOBULIN HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY H  35
ALA H  79
THR H  58
SER H  71
ALA H  72
 None
 1.43A 1gtnO-2h32H:
1.5
1gtnP-2h32H:
undetectable		 1gtnO-2h32H:
15.28
1gtnP-2h32H:
15.28
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.
2hlp MALATE DEHYDROGENASE

(Haloarcula
marismortui) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  28
ALA A  36
THR A 138
THR A  97
ALA A 251
 None
 1.09A 1gtnO-2hlpA:
undetectable
1gtnP-2hlpA:
undetectable		 1gtnO-2hlpA:
14.62
1gtnP-2hlpA:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		5 GLY A  87
ALA A  92
THR A  60
SER A  94
ALA A  93
 SAM  A 300 (-3.2A)
None
None
None
None
 1.24A 1gtnO-2oxtA:
undetectable
1gtnP-2oxtA:
undetectable		 1gtnO-2oxtA:
11.76
1gtnP-2oxtA:
11.76
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.
2pbh PROCATHEPSIN B

(Homo sapiens) 		PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1) 		5 GLY A  74
ALA A  79
HIS A 199
THR A  44
ALA A  34
 None
 1.41A 1gtnO-2pbhA:
undetectable
1gtnP-2pbhA:
undetectable		 1gtnO-2pbhA:
11.78
1gtnP-2pbhA:
11.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pqd 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Agrobacterium
sp.) 		PF00275
(EPSP_synthase) 		5 HIS A  32
THR A 203
HIS A 202
THR A 101
SER A 178
 None
None
None
GG9  A 501 (-3.3A)
GG9  A 501 ( 4.8A)
 1.31A 1gtnO-2pqdA:
undetectable
1gtnP-2pqdA:
undetectable		 1gtnO-2pqdA:
10.20
1gtnP-2pqdA:
10.20
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.
2qae DIHYDROLIPOYL
DEHYDROGENASE

(Trypanosoma
cruzi) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 441
HIS A 445
ALA A 435
THR A 443
ALA A 430
 None
 1.21A 1gtnO-2qaeA:
undetectable
1gtnP-2qaeA:
undetectable		 1gtnO-2qaeA:
10.26
1gtnP-2qaeA:
10.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rbc SUGAR KINASE

(Agrobacterium
fabrum) 		PF00294
(PfkB) 		5 GLY A 258
HIS A 257
ALA A 281
THR A 259
SER A 278
 None
None
EDO  A 331 ( 3.7A)
None
EDO  A 331 (-3.3A)
 1.35A 1gtnO-2rbcA:
undetectable
1gtnP-2rbcA:
undetectable		 1gtnO-2rbcA:
11.54
1gtnP-2rbcA:
11.54
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.
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
 1.21A 1gtnO-2xzlA:
undetectable
1gtnP-2xzlA:
undetectable		 1gtnO-2xzlA:
7.24
1gtnP-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
 1.37A 1gtnO-3a1nA:
undetectable
1gtnP-3a1nA:
undetectable		 1gtnO-3a1nA:
13.02
1gtnP-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.
3b0b CENTROMERE PROTEIN S
CENTROMERE PROTEIN X

(Gallus gallus;
Gallus gallus) 		no annotation
PF09415
(CENP-X) 		5 ALA C  47
THR B  24
HIS B  21
THR B  43
ALA C  48
 None
 1.42A 1gtnO-3b0bC:
undetectable
1gtnP-3b0bC:
undetectable		 1gtnO-3b0bC:
21.33
1gtnP-3b0bC:
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.
3e8o UNCHARACTERIZED
PROTEIN WITH
FERREDOXIN-LIKE FOLD

(Deinococcus
radiodurans) 		PF03992
(ABM) 		5 GLY A  77
HIS A  80
HIS A  82
SER A  21
ALA A 107
 None
None
UNL  A 200 (-4.1A)
UNL  A 200 ( 4.9A)
None
 1.16A 1gtnO-3e8oA:
undetectable
1gtnP-3e8oA:
undetectable		 1gtnO-3e8oA:
19.83
1gtnP-3e8oA:
19.83
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.
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
 1.26A 1gtnO-3eegA:
undetectable
1gtnP-3eegA:
undetectable		 1gtnO-3eegA:
17.23
1gtnP-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.
3egj N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Vibrio cholerae) 		PF01979
(Amidohydro_1) 		5 GLY A 191
ALA A 200
THR A 219
THR A 193
ALA A 231
 None
 1.47A 1gtnO-3egjA:
undetectable
1gtnP-3egjA:
undetectable		 1gtnO-3egjA:
12.82
1gtnP-3egjA:
12.82
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.
3fsx TETRAHYDRODIPICOLINA
TE
N-SUCCINYLTRANSFERAS
E

(Mycobacterium
tuberculosis) 		PF14602
(Hexapep_2)
PF14789
(THDPS_M) 		5 GLY A   9
HIS A  90
THR A  39
THR A  70
ALA A  13
 None
 1.34A 1gtnO-3fsxA:
undetectable
1gtnP-3fsxA:
undetectable		 1gtnO-3fsxA:
14.29
1gtnP-3fsxA:
14.29
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.
3h0l GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Aquifex
aeolicus) 		PF01425
(Amidase) 		5 GLY A 146
ALA A 152
THR A 134
SER A 154
ALA A 153
 None
 1.48A 1gtnO-3h0lA:
undetectable
1gtnP-3h0lA:
undetectable		 1gtnO-3h0lA:
10.90
1gtnP-3h0lA:
10.90
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.
3h86 ADENYLATE KINASE

(Methanococcus
maripaludis) 		no annotation 5 GLY B  10
HIS B 151
ALA B 159
THR B   9
ALA B 158
 None
 1.42A 1gtnO-3h86B:
undetectable
1gtnP-3h86B:
undetectable		 1gtnO-3h86B:
18.65
1gtnP-3h86B:
18.65
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.
3hjw 50S RIBOSOMAL
PROTEIN L7AE

(Pyrococcus
furiosus) 		PF01248
(Ribosomal_L7Ae) 		5 HIS C  66
THR C  40
THR C  41
SER C  99
ALA C  98
 None
None
None
None
U  D  30 ( 3.5A)
 1.28A 1gtnO-3hjwC:
undetectable
1gtnP-3hjwC:
undetectable		 1gtnO-3hjwC:
24.79
1gtnP-3hjwC:
24.79
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.
3io0 ETUB PROTEIN

(Clostridium
kluyveri) 		PF00936
(BMC) 		5 GLY A 122
HIS A 156
THR A 150
THR A 260
ALA A 226
 None
 1.16A 1gtnO-3io0A:
undetectable
1gtnP-3io0A:
undetectable		 1gtnO-3io0A:
15.65
1gtnP-3io0A:
15.65
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.
3k9d ALDEHYDE
DEHYDROGENASE

(Listeria
monocytogenes) 		PF00171
(Aldedh) 		5 GLY A  47
ALA A 161
THR A 129
SER A 159
ALA A 162
 None
 1.30A 1gtnO-3k9dA:
undetectable
1gtnP-3k9dA:
undetectable		 1gtnO-3k9dA:
9.13
1gtnP-3k9dA:
9.13
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.
3kfu GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Thermus
thermophilus) 		PF01425
(Amidase) 		5 GLY E  36
THR E 120
THR E 128
THR E 109
ALA E 146
 None
 1.41A 1gtnO-3kfuE:
undetectable
1gtnP-3kfuE:
undetectable		 1gtnO-3kfuE:
9.27
1gtnP-3kfuE:
9.27
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.
3kto RESPONSE REGULATOR
RECEIVER PROTEIN

(Pseudoalteromonas
atlantica) 		PF00072
(Response_reg) 		5 GLY A  72
ALA A 103
THR A  88
SER A 107
ALA A 106
 None
 1.18A 1gtnO-3ktoA:
undetectable
1gtnP-3ktoA:
undetectable		 1gtnO-3ktoA:
18.94
1gtnP-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.
3l6c SERINE RACEMASE

(Rattus
norvegicus) 		PF00291
(PALP) 		5 GLY A  85
ALA A  90
THR A  81
HIS A  82
ALA A  60
 MLI  A 341 ( 4.9A)
None
None
None
None
 1.21A 1gtnO-3l6cA:
undetectable
1gtnP-3l6cA:
undetectable		 1gtnO-3l6cA:
14.11
1gtnP-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  85
ALA A  90
THR A  81
HIS A  82
ALA A  60
 MLI  A 347 ( 4.8A)
LLP  A  56 ( 3.6A)
None
None
LLP  A  56 ( 3.5A)
 1.24A 1gtnO-3l6rA:
undetectable
1gtnP-3l6rA:
undetectable		 1gtnO-3l6rA:
12.84
1gtnP-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.
3pea ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Bacillus
anthracis) 		PF00378
(ECH_1) 		5 GLY A 104
HIS A 103
ALA A  61
HIS A  53
ALA A  23
 None
 1.13A 1gtnO-3peaA:
undetectable
1gtnP-3peaA:
undetectable		 1gtnO-3peaA:
15.87
1gtnP-3peaA:
15.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qom 6-PHOSPHO-BETA-GLUCO
SIDASE

(Lactobacillus
plantarum) 		PF00232
(Glyco_hydro_1) 		5 GLY A  26
HIS A  64
THR A  95
SER A  35
ALA A  37
 None
PO4  A 482 (-3.7A)
None
None
None
 1.48A 1gtnO-3qomA:
undetectable
1gtnP-3qomA:
undetectable		 1gtnO-3qomA:
11.23
1gtnP-3qomA:
11.23
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.
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
 1.18A 1gtnO-3rwbA:
undetectable
1gtnP-3rwbA:
undetectable		 1gtnO-3rwbA:
16.06
1gtnP-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.
3u0f BETA-KETOACYL
SYNTHASE

(Brucella
abortus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 332
HIS A 333
ALA A 219
THR A 327
ALA A 297
 None
 1.42A 1gtnO-3u0fA:
undetectable
1gtnP-3u0fA:
undetectable		 1gtnO-3u0fA:
10.22
1gtnP-3u0fA:
10.22
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.
3w5n PUTATIVE
RHAMNOSIDASE

(Streptomyces
avermitilis) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 GLY A 569
HIS A 568
ALA A 545
THR A 539
ALA A 546
 None
 1.20A 1gtnO-3w5nA:
1.5
1gtnP-3w5nA:
2.1		 1gtnO-3w5nA:
5.72
1gtnP-3w5nA:
5.72
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.
3zrp SERINE-PYRUVATE
AMINOTRANSFERASE
(AGXT)

(Sulfolobus
solfataricus) 		PF00266
(Aminotran_5) 		5 GLY A 164
HIS A 135
ALA A 190
THR A 185
ALA A 170
 None
 1.45A 1gtnO-3zrpA:
undetectable
1gtnP-3zrpA:
undetectable		 1gtnO-3zrpA:
12.03
1gtnP-3zrpA:
12.03
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
HIS A  34
THR A  49
HIS A  51
THR A  52
 TRP  A  80 (-3.5A)
None
TRP  A  80 ( 4.9A)
TRP  A  80 (-2.8A)
None
TRP  A  80 (-3.6A)
 0.38A 1gtnO-3zteA:
14.8
1gtnP-3zteA:
14.2		 1gtnO-3zteA:
78.21
1gtnP-3zteA:
78.21
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) 		7 GLY A  23
HIS A  33
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A  81 (-3.5A)
None
TRP  A  81 ( 4.7A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
 0.43A 1gtnO-3zzlA:
12.9
1gtnP-3zzlA:
13.0		 1gtnO-3zzlA:
71.43
1gtnP-3zzlA:
71.43
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) 		7 GLY A  23
HIS A  33
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 TRP  A  81 (-3.5A)
None
TRP  A  81 ( 4.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
TRP  A  81 ( 3.7A)
 1.00A 1gtnO-3zzlA:
12.9
1gtnP-3zzlA:
13.0		 1gtnO-3zzlA:
71.43
1gtnP-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
HIS A  34
ALA A  46
THR A  49
THR A  52
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
 0.28A 1gtnO-3zzqA:
13.5
1gtnP-3zzqA:
13.5		 1gtnO-3zzqA:
80.00
1gtnP-3zzqA:
80.00
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
HIS A  34
THR A  49
THR A  52
ALA A  46
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 3.7A)
 1.06A 1gtnO-3zzqA:
13.5
1gtnP-3zzqA:
13.5		 1gtnO-3zzqA:
80.00
1gtnP-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
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A1072 (-3.5A)
None
TRP  A1072 ( 4.7A)
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
 0.26A 1gtnO-3zzsA:
13.3
1gtnP-3zzsA:
13.4		 1gtnO-3zzsA:
100.00
1gtnP-3zzsA:
100.00
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
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 TRP  A1072 (-3.5A)
None
TRP  A1072 ( 4.7A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
TRP  A1072 ( 3.8A)
 1.08A 1gtnO-3zzsA:
13.3
1gtnP-3zzsA:
13.4		 1gtnO-3zzsA:
100.00
1gtnP-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
 1.33A 1gtnO-4a0sA:
undetectable
1gtnP-4a0sA:
undetectable		 1gtnO-4a0sA:
10.76
1gtnP-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.
4avc LYSINE
ACETYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00027
(cNMP_binding)
PF13302
(Acetyltransf_3) 		5 GLY A  28
ALA A  33
THR A 120
SER A  35
ALA A  34
 None
 1.22A 1gtnO-4avcA:
undetectable
1gtnP-4avcA:
undetectable		 1gtnO-4avcA:
11.71
1gtnP-4avcA:
11.71
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
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 GLY  A  23 (-0.0A)
HIS  A  33 ( 1.0A)
HIS  A  34 ( 1.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
 0.37A 1gtnO-4b27A:
13.0
1gtnP-4b27A:
13.0		 1gtnO-4b27A:
76.32
1gtnP-4b27A:
76.32
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) 		6 HIS A  33
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 HIS  A  33 ( 1.0A)
HIS  A  34 ( 1.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
ALA  A  46 ( 0.0A)
 1.11A 1gtnO-4b27A:
13.0
1gtnP-4b27A:
13.0		 1gtnO-4b27A:
76.32
1gtnP-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.
4c6y BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		5 GLY A  62
ALA A 187
THR A 181
THR A 182
ALA A 188
 None
PEG  A 301 ( 3.6A)
None
None
PEG  A 294 (-2.5A)
 1.32A 1gtnO-4c6yA:
undetectable
1gtnP-4c6yA:
undetectable		 1gtnO-4c6yA:
15.18
1gtnP-4c6yA:
15.18
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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		5 GLY A  81
HIS A 123
ALA A 131
THR A 117
ALA A 138
 LLP  A  77 ( 4.0A)
None
None
None
None
 1.33A 1gtnO-4d9iA:
undetectable
1gtnP-4d9iA:
undetectable		 1gtnO-4d9iA:
11.42
1gtnP-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.
4d9i DIAMINOPROPIONATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00291
(PALP) 		5 GLY A 124
HIS A 123
ALA A 138
THR A 117
ALA A 131
 None
 1.26A 1gtnO-4d9iA:
undetectable
1gtnP-4d9iA:
undetectable		 1gtnO-4d9iA:
11.42
1gtnP-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.
4ebj AMINOGLYCOSIDE
NUCLEOTIDYLTRANSFERA
SE

(Pseudomonas
aeruginosa) 		PF01909
(NTP_transf_2) 		5 GLY A  90
ALA A 177
THR A  93
HIS A 118
ALA A 174
 None
None
None
None
SO4  A 303 (-3.6A)
 1.13A 1gtnO-4ebjA:
undetectable
1gtnP-4ebjA:
undetectable		 1gtnO-4ebjA:
14.71
1gtnP-4ebjA:
14.71
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.
4ep6 CYTOCHROME P450-LIKE
PROTEIN XPLA

(Rhodococcus
rhodochrous) 		PF00067
(p450) 		5 GLY A 239
HIS A 245
THR A 384
THR A 236
ALA A 504
 None
HEM  A 601 (-3.8A)
None
None
HEM  A 601 ( 3.7A)
 1.23A 1gtnO-4ep6A:
undetectable
1gtnP-4ep6A:
undetectable		 1gtnO-4ep6A:
11.92
1gtnP-4ep6A:
11.92
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		5 GLY A 358
HIS A 359
ALA A 366
THR A 418
ALA A 365
 AMP  A 602 (-3.6A)
ZN  A 601 (-3.4A)
None
None
None
 1.39A 1gtnO-4gvlA:
undetectable
1gtnP-4gvlA:
undetectable		 1gtnO-4gvlA:
10.47
1gtnP-4gvlA:
10.47
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.
4gx0 TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N)
PF07885
(Ion_trans_2) 		5 GLY A 358
HIS A 359
ALA A 366
THR A 418
ALA A 365
 None
ZN  A 606 (-3.5A)
None
None
None
 1.31A 1gtnO-4gx0A:
undetectable
1gtnP-4gx0A:
undetectable		 1gtnO-4gx0A:
8.70
1gtnP-4gx0A:
8.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hds ARSA

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 GLY A 294
ALA A 309
THR A 270
SER A 290
ALA A 289
 None
 1.32A 1gtnO-4hdsA:
undetectable
1gtnP-4hdsA:
undetectable		 1gtnO-4hdsA:
12.75
1gtnP-4hdsA:
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.
4hp8 2-DEOXY-D-GLUCONATE
3-DEHYDROGENASE

(Agrobacterium
fabrum) 		PF13561
(adh_short_C2) 		5 GLY A 158
HIS A 157
ALA A 138
THR A 163
ALA A 181
 None
 1.43A 1gtnO-4hp8A:
undetectable
1gtnP-4hp8A:
undetectable		 1gtnO-4hp8A:
15.26
1gtnP-4hp8A:
15.26
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.
4huc PROBABLE CONSERVED
LIPOPROTEIN LPPS

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		5 GLY A 353
THR A 380
THR A 287
THR A 278
ALA A 257
 None
 1.39A 1gtnO-4hucA:
undetectable
1gtnP-4hucA:
undetectable		 1gtnO-4hucA:
14.94
1gtnP-4hucA:
14.94
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.
4mla CYTOKININ OXIDASE 2

(Zea mays) 		PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind) 		5 GLY A 136
ALA A  95
HIS A  98
THR A 163
SER A 106
 None
FAD  A 601 (-3.7A)
IPA  A 604 ( 4.1A)
FAD  A 601 (-2.9A)
FAD  A 601 (-3.7A)
 1.40A 1gtnO-4mlaA:
undetectable
1gtnP-4mlaA:
undetectable		 1gtnO-4mlaA:
9.98
1gtnP-4mlaA:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.08A 1gtnO-4ov4A:
undetectable
1gtnP-4ov4A:
undetectable		 1gtnO-4ov4A:
11.11
1gtnP-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.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B SUBUNIT 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12265
(CAF1C_H4-bd) 		5 GLY B  62
HIS B 117
THR B  65
HIS B  64
THR B  63
 None
 1.44A 1gtnO-4pswB:
undetectable
1gtnP-4pswB:
undetectable		 1gtnO-4pswB:
12.07
1gtnP-4pswB:
12.07
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.
4pzc 3-HYDROXYACYL-COA
DEHYDROGENASE

(Cupriavidus
necator) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A 156
THR A 163
HIS A 164
THR A 159
ALA A 115
 None
 1.14A 1gtnO-4pzcA:
undetectable
1gtnP-4pzcA:
undetectable		 1gtnO-4pzcA:
14.04
1gtnP-4pzcA:
14.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q0g PROBABLE
ACETYL-/PROPIONYL-CO
A CARBOXYLASE (BETA
SUBUNIT) ACCD1

(Mycobacterium
tuberculosis) 		PF01039
(Carboxyl_trans) 		6 GLY A  84
ALA A  71
HIS A 119
THR A 115
THR A  87
ALA A  68
 None
 1.35A 1gtnO-4q0gA:
undetectable
1gtnP-4q0gA:
undetectable		 1gtnO-4q0gA:
9.33
1gtnP-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.
4qn8 VIPE

(Legionella
pneumophila) 		no annotation 5 GLY A  68
HIS A 112
ALA A 104
THR A  80
ALA A 107
 None
 1.12A 1gtnO-4qn8A:
undetectable
1gtnP-4qn8A:
undetectable		 1gtnO-4qn8A:
18.12
1gtnP-4qn8A:
18.12
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.
4qtf L,D-TRANSPEPTIDASE
LDTB

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		5 GLY A 353
THR A 380
THR A 287
THR A 278
ALA A 257
 3V5  A 502 (-3.7A)
None
None
None
None
 1.41A 1gtnO-4qtfA:
undetectable
1gtnP-4qtfA:
undetectable		 1gtnO-4qtfA:
12.89
1gtnP-4qtfA:
12.89
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.
4uph SULFATASE (SULFURIC
ESTER HYDROLASE)
PROTEIN

(Agrobacterium
tumefaciens) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 HIS A  80
ALA A  59
HIS A 498
SER A 373
ALA A 374
 None
 1.36A 1gtnO-4uphA:
undetectable
1gtnP-4uphA:
undetectable		 1gtnO-4uphA:
10.02
1gtnP-4uphA:
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.
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
 1.11A 1gtnO-4xgnA:
undetectable
1gtnP-4xgnA:
undetectable		 1gtnO-4xgnA:
13.85
1gtnP-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.
4xr9 CALS8

(Micromonospora
echinospora) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 GLY A  54
ALA A  78
THR A  47
THR A  25
ALA A  40
 None
None
NAD  A 501 ( 4.5A)
None
None
 1.32A 1gtnO-4xr9A:
undetectable
1gtnP-4xr9A:
undetectable		 1gtnO-4xr9A:
10.07
1gtnP-4xr9A:
10.07
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.
4z2a FURIN

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		5 HIS A 364
ALA A 371
HIS A 194
SER A 253
ALA A 292
 PO4  A 605 (-3.7A)
None
PO4  A 605 (-4.3A)
None
None
 1.14A 1gtnO-4z2aA:
undetectable
1gtnP-4z2aA:
undetectable		 1gtnO-4z2aA:
9.03
1gtnP-4z2aA:
9.03
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.
4zej METALLO-BETA-LACTAMA
SE

(Pseudomonas
stutzeri) 		no annotation 5 GLY A 156
ALA A 186
HIS A 139
THR A 212
ALA A 183
 None
None
ZN  A 302 (-3.3A)
None
None
 1.20A 1gtnO-4zejA:
undetectable
1gtnP-4zejA:
undetectable		 1gtnO-4zejA:
18.55
1gtnP-4zejA:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b7n MTA/SAH NUCLEOSIDASE

(Aeromonas
hydrophila) 		PF01048
(PNP_UDP_1) 		5 GLY A 115
ALA A 105
THR A 245
HIS A 248
ALA A 217
 None
 1.04A 1gtnO-5b7nA:
undetectable
1gtnP-5b7nA:
undetectable		 1gtnO-5b7nA:
15.74
1gtnP-5b7nA:
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.
5ce5 TRIACYLGLYCEROL
LIPASE

(Geobacillus
thermocatenulatus) 		no annotation 5 GLY A 116
HIS A  15
ALA A 241
THR A 119
SER A  58
 None
 1.43A 1gtnO-5ce5A:
undetectable
1gtnP-5ce5A:
undetectable		 1gtnO-5ce5A:
11.23
1gtnP-5ce5A:
11.23
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.
5d04 PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE

(Neisseria
meningitidis) 		PF00793
(DAHP_synth_1) 		5 GLY C 180
ALA C 205
HIS C 210
THR C 225
ALA C 204
 None
 1.32A 1gtnO-5d04C:
undetectable
1gtnP-5d04C:
undetectable		 1gtnO-5d04C:
13.33
1gtnP-5d04C:
13.33
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.
5e2e BETA-LACTAMASE

(Yersinia
enterocolitica) 		PF13354
(Beta-lactamase2) 		5 GLY A  39
ALA A 164
THR A 158
THR A 159
ALA A 165
 None
 1.29A 1gtnO-5e2eA:
undetectable
1gtnP-5e2eA:
undetectable		 1gtnO-5e2eA:
12.88
1gtnP-5e2eA:
12.88
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
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 None
 0.27A 1gtnO-5eexA:
15.1
1gtnP-5eexA:
15.2		 1gtnO-5eexA:
100.00
1gtnP-5eexA:
100.00
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
HIS A  34
THR A  49
HIS A  51
THR A  52
ALA A  46
 None
 1.10A 1gtnO-5eexA:
15.1
1gtnP-5eexA:
15.2		 1gtnO-5eexA:
100.00
1gtnP-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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		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 120
THR A  53
THR A 127
SER A 347
ALA A 143
 None
 1.41A 1gtnO-5epgA:
undetectable
1gtnP-5epgA:
undetectable		 1gtnO-5epgA:
4.77
1gtnP-5epgA:
4.77
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.
5eso 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Mycobacterium
tuberculosis) 		PF02776
(TPP_enzyme_N) 		5 HIS A 232
ALA A 402
THR A 279
THR A 250
ALA A 376
 None
 1.04A 1gtnO-5esoA:
undetectable
1gtnP-5esoA:
undetectable		 1gtnO-5esoA:
7.88
1gtnP-5esoA:
7.88
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.
5gin 50S RIBOSOMAL
PROTEIN L7AE

(Sulfolobus
solfataricus) 		PF01248
(Ribosomal_L7Ae) 		5 HIS C  68
THR C  42
THR C  43
SER C 101
ALA C 100
 None
None
None
None
U  H  11 ( 3.7A)
 1.23A 1gtnO-5ginC:
undetectable
1gtnP-5ginC:
undetectable		 1gtnO-5ginC:
22.31
1gtnP-5ginC:
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.
5hrm HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 5 GLY A 271
HIS A 286
THR A 202
HIS A 258
ALA A 232
 None
None
None
MN  A 602 (-3.2A)
None
 1.26A 1gtnO-5hrmA:
undetectable
1gtnP-5hrmA:
undetectable		 1gtnO-5hrmA:
9.68
1gtnP-5hrmA:
9.68
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.
5ioj HALOALKYLPHOSPHORUS
HYDROLASE

(Sphingobium sp.
TCM1) 		no annotation 5 GLY A 271
HIS A 286
THR A 202
HIS A 258
ALA A 232
 None
 1.23A 1gtnO-5iojA:
undetectable
1gtnP-5iojA:
undetectable		 1gtnO-5iojA:
8.40
1gtnP-5iojA:
8.40
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.
5k69 L,D-TRANSPEPTIDASE 2

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		5 GLY A 353
THR A 380
THR A 287
THR A 278
ALA A 257
 6QR  A 503 (-3.9A)
None
None
None
None
 1.40A 1gtnO-5k69A:
undetectable
1gtnP-5k69A:
undetectable		 1gtnO-5k69A:
11.27
1gtnP-5k69A:
11.27
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.
5kgn 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Caenorhabditis
elegans) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 GLY A 139
ALA A 213
HIS A 136
THR A 206
ALA A 226
 None
 1.12A 1gtnO-5kgnA:
undetectable
1gtnP-5kgnA:
undetectable		 1gtnO-5kgnA:
11.00
1gtnP-5kgnA:
11.00
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.
5nqd ARSENITE OXIDASE
LARGE SUBUNIT AIOA
[3FE-4S] CLUSTER,
MO-MOLYBDOPTERIN
COFACTOR-BINDING
ACTIVE SITE

(Rhizobium sp.
NT-26) 		no annotation 5 GLY A  30
THR A 580
THR A  23
SER A 563
ALA A 173
 F3S  A2005 (-4.1A)
None
None
None
MGD  A2001 ( 4.7A)
 1.36A 1gtnO-5nqdA:
undetectable
1gtnP-5nqdA:
undetectable		 1gtnO-5nqdA:
undetectable
1gtnP-5nqdA:
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.
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
 1.44A 1gtnO-5ujuA:
undetectable
1gtnP-5ujuA:
undetectable		 1gtnO-5ujuA:
8.35
1gtnP-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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLY A 538
HIS A 542
ALA A 481
HIS A 755
THR A 541
 None
 1.19A 1gtnO-5ux5A:
undetectable
1gtnP-5ux5A:
undetectable		 1gtnO-5ux5A:
5.76
1gtnP-5ux5A:
5.76
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.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLY A 874
ALA A 726
THR A 846
SER A 724
ALA A 725
 None
None
None
SO4  A2003 (-2.4A)
None
 1.21A 1gtnO-5ux5A:
undetectable
1gtnP-5ux5A:
undetectable		 1gtnO-5ux5A:
5.76
1gtnP-5ux5A:
5.76
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.
5wka BETA-GLUCOSIDASE

(metagenome) 		no annotation 5 GLY A 213
HIS A 196
ALA A 203
THR A 158
ALA A 202
 None
 1.41A 1gtnO-5wkaA:
undetectable
1gtnP-5wkaA:
undetectable		 1gtnO-5wkaA:
undetectable
1gtnP-5wkaA:
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.
5xd7 3,6-ANHYDRO-ALPHA-L-
GALACTONATE
CYCLOISOMERASE

(Vibrio sp. EJY3) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 HIS A 306
ALA A 287
HIS A 300
THR A 299
ALA A 286
 None
None
ACY  A 403 (-4.1A)
None
None
 1.17A 1gtnO-5xd7A:
undetectable
1gtnP-5xd7A:
undetectable		 1gtnO-5xd7A:
11.52
1gtnP-5xd7A:
11.52
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.
5ybw ASPARTATE RACEMASE

(Scapharca
broughtonii) 		no annotation 5 GLY A  90
ALA A  95
THR A  86
HIS A  87
ALA A  67
 None
LLP  A  63 ( 3.4A)
None
None
LLP  A  63 ( 3.2A)
 1.24A 1gtnO-5ybwA:
undetectable
1gtnP-5ybwA:
undetectable		 1gtnO-5ybwA:
undetectable
1gtnP-5ybwA:
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  82
HIS A 128
ALA A 136
THR A 122
ALA A 143
 LLP  A  78 ( 4.2A)
None
None
None
None
 1.25A 1gtnO-5ygrA:
undetectable
1gtnP-5ygrA:
undetectable		 1gtnO-5ygrA:
undetectable
1gtnP-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.
5ygr DIAMINOPROPIONATE
AMMONIA LYASE

(Salmonella
enterica) 		no annotation 5 GLY A 129
HIS A 128
ALA A 143
THR A 122
ALA A 136
 None
 1.34A 1gtnO-5ygrA:
undetectable
1gtnP-5ygrA:
undetectable		 1gtnO-5ygrA:
undetectable
1gtnP-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.
6aoo MALATE DEHYDROGENASE

(Haemophilus
influenzae) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A 115
ALA A 235
THR A 148
HIS A 177
ALA A 232
 None
 1.47A 1gtnO-6aooA:
undetectable
1gtnP-6aooA:
undetectable		 1gtnO-6aooA:
14.16
1gtnP-6aooA:
14.16