SIMILAR PATTERNS OF AMINO ACIDS FOR 6GSD_A_STRA401

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.
1bpo PROTEIN (CLATHRIN)

(Rattus
norvegicus)
PF01394
(Clathrin_propel)
PF09268
(Clathrin-link)
PF13838
(Clathrin_H_link)
5 PHE A  37
ILE A  52
SER A  97
VAL A  79
ILE A  80
None
1.38A 6gsdA-1bpoA:
undetectable
6gsdA-1bpoA:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c9l CLATHRIN

(Rattus
norvegicus)
PF01394
(Clathrin_propel)
PF09268
(Clathrin-link)
5 PHE A  37
ILE A  52
SER A  97
VAL A  79
ILE A  80
None
1.23A 6gsdA-1c9lA:
undetectable
6gsdA-1c9lA:
13.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cnv CONCANAVALIN B

(Canavalia
ensiformis)
PF00704
(Glyco_hydro_18)
5 ARG A 187
VAL A 186
ILE A 184
TRP A 139
ILE A 176
None
1.30A 6gsdA-1cnvA:
undetectable
6gsdA-1cnvA:
12.98
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.
1dci DIENOYL-COA
ISOMERASE


(Rattus
norvegicus)
PF00378
(ECH_1)
5 VAL A  69
PHE A  84
ILE A  57
SER A  96
VAL A  89
None
1.25A 6gsdA-1dciA:
undetectable
6gsdA-1dciA:
16.88
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.
1dd5 RIBOSOME RECYCLING
FACTOR


(Thermotoga
maritima)
PF01765
(RRF)
5 VAL A  51
ILE A  78
SER A  58
VAL A  97
ILE A  98
None
1.41A 6gsdA-1dd5A:
undetectable
6gsdA-1dd5A:
20.11
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT


(Methanopyrus
kandleri)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
5 PHE A 516
ILE A 512
ASN A 279
VAL A 108
ILE A 109
None
1.39A 6gsdA-1e6vA:
undetectable
6gsdA-1e6vA:
10.85
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT


(Methanopyrus
kandleri)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
5 PHE A 516
ILE A 512
ASN A 279
VAL A 108
ILE A 264
None
1.07A 6gsdA-1e6vA:
undetectable
6gsdA-1e6vA:
10.85
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT


(Methanopyrus
kandleri)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
5 VAL A 288
ILE A 512
ASN A 279
VAL A 108
ILE A 264
None
0.94A 6gsdA-1e6vA:
undetectable
6gsdA-1e6vA:
10.85
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.
1ezr NUCLEOSIDE HYDROLASE

(Leishmania
major)
PF01156
(IU_nuc_hydro)
5 LYS A 147
VAL A 146
ILE A 121
VAL A 124
ILE A   6
None
1.38A 6gsdA-1ezrA:
6.3
6gsdA-1ezrA:
14.84
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.
1j32 ASPARTATE
AMINOTRANSFERASE


(Phormidium
lapideum)
PF00155
(Aminotran_1_2)
5 LYS A 150
VAL A 151
SER A 201
VAL A 185
ILE A 188
None
1.47A 6gsdA-1j32A:
undetectable
6gsdA-1j32A:
11.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o9j ALDEHYDE
DEHYDROGENASE,
CYTOSOLIC 1


(Elephantulus
edwardii)
PF00171
(Aldedh)
5 VAL A  63
ILE A 190
SER A 260
VAL A 241
ILE A 232
None
1.24A 6gsdA-1o9jA:
2.9
6gsdA-1o9jA:
10.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pgj 6-PHOSPHOGLUCONATE
DEHYDROGENASE


(Trypanosoma
brucei)
PF00393
(6PGD)
PF03446
(NAD_binding_2)
5 VAL A 202
ILE A 205
SER A 431
VAL A 414
ILE A 425
None
1.45A 6gsdA-1pgjA:
6.9
6gsdA-1pgjA:
10.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pw5 NAGD PROTEIN,
PUTATIVE


(Thermotoga
maritima)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
5 ARG A 202
VAL A 198
PHE A   8
VAL A 223
ILE A 222
None
1.46A 6gsdA-1pw5A:
3.5
6gsdA-1pw5A:
14.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qgz PROTEIN
(FERREDOXIN:NADP+
REDUCTASE)


(Nostoc sp. PCC
7119)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
5 VAL A 130
PHE A  21
ILE A 132
SER A  27
ILE A  95
None
1.39A 6gsdA-1qgzA:
4.2
6gsdA-1qgzA:
16.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qvz YDR533C PROTEIN

(Saccharomyces
cerevisiae)
PF01965
(DJ-1_PfpI)
5 VAL A 133
PHE A  43
ILE A 101
SER A 209
VAL A 229
None
1.33A 6gsdA-1qvzA:
5.6
6gsdA-1qvzA:
16.74
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.
1r1a HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP1)


(Rhinovirus A)
PF00073
(Rhv)
5 ARG 1 158
VAL 1  84
ILE 1 235
VAL 1 142
ILE 1 141
None
1.30A 6gsdA-1r1a1:
undetectable
6gsdA-1r1a1:
12.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vpl ABC TRANSPORTER,
ATP-BINDING PROTEIN


(Thermotoga
maritima)
PF00005
(ABC_tran)
5 ARG A 224
LYS A 222
VAL A 233
ILE A 230
ILE A 204
None
1.18A 6gsdA-1vplA:
undetectable
6gsdA-1vplA:
15.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eyn ALPHA-ACTININ 1

(Homo sapiens)
PF00307
(CH)
5 LYS A 103
VAL A 105
PHE A  99
ILE A 100
ILE A 130
None
1.01A 6gsdA-2eynA:
undetectable
6gsdA-2eynA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ghi TRANSPORT PROTEIN

(Plasmodium
yoelii)
PF00005
(ABC_tran)
5 PHE A  20
ILE A  18
SER A  90
VAL A  83
ILE A  78
None
1.38A 6gsdA-2ghiA:
undetectable
6gsdA-2ghiA:
13.08
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.
2kbs HARMONIN

(Homo sapiens)
PF00595
(PDZ)
5 LYS A  12
VAL A  13
ILE A  87
VAL A  60
ILE A  59
None
1.38A 6gsdA-2kbsA:
undetectable
6gsdA-2kbsA:
18.75
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.
2l6g FOCAL ADHESION
KINASE 1, LINKER,
PAXILLIN


(Gallus gallus;
unidentified)
PF03535
(Paxillin)
PF03623
(Focal_AT)
5 VAL A  58
ILE A  73
ASN A 123
VAL A 127
ILE A 128
None
1.47A 6gsdA-2l6gA:
undetectable
6gsdA-2l6gA:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o3j UDP-GLUCOSE
6-DEHYDROGENASE


(Caenorhabditis
elegans)
PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N)
5 VAL A 117
ILE A 121
VAL A 132
ILE A  90
CYH A  14
None
1.17A 6gsdA-2o3jA:
5.8
6gsdA-2o3jA:
10.94
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.
2qfr PURPLE ACID
PHOSPHATASE


(Phaseolus
vulgaris)
PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N)
5 ARG A 112
VAL A 105
ILE A  44
VAL A 190
ILE A  32
None
1.49A 6gsdA-2qfrA:
2.5
6gsdA-2qfrA:
11.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qgy ENOLASE FROM THE
ENVIRONMENTAL GENOME
SHOTGUN SEQUENCING
OF THE SARGASSO SEA


(-)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 VAL A 189
PHE A 158
ILE A 155
TRP A 222
ILE A 168
None
1.43A 6gsdA-2qgyA:
undetectable
6gsdA-2qgyA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v6b L-LACTATE
DEHYDROGENASE


(Deinococcus
radiodurans)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 VAL A 166
ILE A 257
SER A 286
VAL A 137
ILE A 161
None
1.35A 6gsdA-2v6bA:
7.6
6gsdA-2v6bA:
14.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v6g PROGESTERONE
5-BETA-REDUCTASE


(Digitalis
lanata)
PF01370
(Epimerase)
8 ARG A 146
LYS A 147
PHE A 153
ASN A 205
MET A 215
SER A 248
TRP A 284
CYH A 352
None
NAP  A1390 (-4.5A)
None
None
None
None
None
None
0.72A 6gsdA-2v6gA:
58.9
6gsdA-2v6gA:
89.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xh1 KYNURENINE/ALPHA-AMI
NOADIPATE
AMINOTRANSFERASE,
MITOCHONDRIAL


(Homo sapiens)
PF00155
(Aminotran_1_2)
5 ARG A 321
VAL A 322
PHE A 235
ILE A 264
ILE A 265
None
1.30A 6gsdA-2xh1A:
3.8
6gsdA-2xh1A:
10.00
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.
2xka FTSZ/TUBULIN-RELATED
PROTEIN


(Bacillus
thuringiensis)
PF00091
(Tubulin)
5 VAL A 208
PHE A 189
ILE A 186
TRP A 145
VAL A 149
None
1.43A 6gsdA-2xkaA:
6.0
6gsdA-2xkaA:
13.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xq1 PEROXISOMAL CATALASE

(Ogataea angusta)
PF00199
(Catalase)
PF06628
(Catalase-rel)
5 ARG A 344
VAL A 340
PHE A 154
ILE A 145
ASN A 138
None
1.45A 6gsdA-2xq1A:
undetectable
6gsdA-2xq1A:
9.55
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.
3bbh RIBOSOME BIOGENESIS
PROTEIN NEP1-LIKE


(Methanocaldococcus
jannaschii)
PF03587
(EMG1)
5 ILE A 185
SER A  61
TRP A 193
ILE A 198
CYH A 196
SFG  A 206 (-4.5A)
None
None
None
None
1.24A 6gsdA-3bbhA:
undetectable
6gsdA-3bbhA:
17.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bzm MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE


(Escherichia
coli)
PF00425
(Chorismate_bind)
5 VAL A 305
ILE A 323
ASN A 285
VAL A 288
ILE A 292
None
1.48A 6gsdA-3bzmA:
undetectable
6gsdA-3bzmA:
10.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fdd L-ASPARTATE-BETA-DEC
ARBOXYLASE


(Comamonas
testosteroni)
PF00155
(Aminotran_1_2)
5 ILE A 511
ASN A  29
MET A  32
VAL A 482
ILE A 475
None
1.10A 6gsdA-3fddA:
2.1
6gsdA-3fddA:
11.48
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.
3fhh OUTER MEMBRANE HEME
RECEPTOR SHUA


(Shigella
dysenteriae)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
5 ARG A  99
ILE A 120
SER A  15
VAL A 103
ILE A 102
None
1.47A 6gsdA-3fhhA:
undetectable
6gsdA-3fhhA:
8.52
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.
3fo8 TAIL SHEATH PROTEIN
GP18


(Escherichia
virus T4)
PF17481
(Phage_sheath_1N)
5 ARG D 284
VAL D 283
ILE D 281
VAL D 239
ILE D 238
ACT  D 601 (-3.8A)
None
None
None
None
1.48A 6gsdA-3fo8D:
undetectable
6gsdA-3fo8D:
16.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i44 ALDEHYDE
DEHYDROGENASE


(Bartonella
henselae)
PF00171
(Aldedh)
5 VAL A 434
ILE A 414
ASN A 404
VAL A 400
ILE A 257
None
1.37A 6gsdA-3i44A:
3.5
6gsdA-3i44A:
12.42
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.
3j0o RIBOSOMAL PROTEIN
S15


(Oryctolagus
cuniculus)
PF00203
(Ribosomal_S19)
5 ARG S  49
VAL S  50
ILE S  34
VAL S  90
ILE S  91
None
1.19A 6gsdA-3j0oS:
undetectable
6gsdA-3j0oS:
18.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jur EXO-POLY-ALPHA-D-GAL
ACTURONOSIDASE


(Thermotoga
maritima)
PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3)
5 VAL A 203
ILE A 226
SER A 191
TRP A 214
ILE A 241
None
1.48A 6gsdA-3jurA:
undetectable
6gsdA-3jurA:
11.06
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.
3ll5 GAMMA-GLUTAMYL
KINASE RELATED
PROTEIN


(Thermoplasma
acidophilum)
PF00696
(AA_kinase)
5 LYS A 213
VAL A 210
ILE A 244
ASN A 188
ILE A 185
None
1.45A 6gsdA-3ll5A:
2.7
6gsdA-3ll5A:
15.10
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.
3num SERINE PROTEASE
HTRA1


(Homo sapiens)
PF13365
(Trypsin_2)
5 VAL A 230
ILE A 186
SER A 210
VAL A 216
ILE A 254
None
1.40A 6gsdA-3numA:
undetectable
6gsdA-3numA:
15.36
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.
3nv9 MALIC ENZYME

(Entamoeba
histolytica)
PF00390
(malic)
PF03949
(Malic_M)
5 VAL A 155
ILE A 158
SER A  99
VAL A  95
ILE A 135
None
1.47A 6gsdA-3nv9A:
2.7
6gsdA-3nv9A:
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.
3nva CTP SYNTHASE

(Sulfolobus
solfataricus)
PF00117
(GATase)
PF06418
(CTP_synth_N)
5 PHE A 173
ILE A 172
SER A 131
VAL A 141
ILE A   6
None
1.48A 6gsdA-3nvaA:
3.4
6gsdA-3nvaA:
9.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nwu SERINE PROTEASE
HTRA1


(Homo sapiens)
PF13365
(Trypsin_2)
5 VAL A 230
ILE A 186
SER A 210
VAL A 216
ILE A 254
None
1.39A 6gsdA-3nwuA:
undetectable
6gsdA-3nwuA:
17.54
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.
3ot5 UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE


(Listeria
monocytogenes)
PF02350
(Epimerase_2)
5 VAL A  78
ILE A  82
MET A 145
VAL A  96
ILE A   9
None
1.07A 6gsdA-3ot5A:
8.4
6gsdA-3ot5A:
10.92
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.
3poh ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE F1


(Bacteroides
thetaiotaomicron)
PF08522
(DUF1735)
5 VAL A 225
MET A 358
SER A 399
VAL A 376
ILE A 375
None
1.26A 6gsdA-3pohA:
undetectable
6gsdA-3pohA:
11.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1)
PF01663
(Phosphodiest)
5 VAL A 501
ILE A 503
SER A  94
VAL A 522
ILE A 524
None
1.43A 6gsdA-3q3qA:
undetectable
6gsdA-3q3qA:
10.64
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
5 PHE A 680
ILE A 494
SER A 510
TRP A 654
ILE A 667
None
1.24A 6gsdA-3rimA:
undetectable
6gsdA-3rimA:
8.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s46 ALANINE RACEMASE

(Streptococcus
pneumoniae)
PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N)
5 VAL A 278
ILE A 313
VAL A 305
ILE A 304
CYH A 302
None
1.25A 6gsdA-3s46A:
undetectable
6gsdA-3s46A:
13.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3txv PROBABLE TAGATOSE
6-PHOSPHATE KINASE


(Sinorhizobium
meliloti)
PF08013
(Tagatose_6_P_K)
5 VAL A  33
PHE A  74
ILE A  34
ILE A  50
CYH A  27
None
1.36A 6gsdA-3txvA:
3.5
6gsdA-3txvA:
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.
3ubm FORMYL-COA:OXALATE
COA-TRANSFERASE


(Acetobacter
aceti)
PF02515
(CoA_transf_3)
5 ARG A  74
VAL A  76
ILE A  42
VAL A  16
ILE A  17
None
1.49A 6gsdA-3ubmA:
5.7
6gsdA-3ubmA:
10.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uyu ANTIFREEZE PROTEIN

(Leucosporidium
sp. AY30)
PF11999
(DUF3494)
5 VAL A  83
PHE A  34
ILE A  54
VAL A  56
ILE A  42
None
1.49A 6gsdA-3uyuA:
undetectable
6gsdA-3uyuA:
15.48
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.
3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX


(Thermoanaerobacter
ethanolicus)
PF02629
(CoA_binding)
PF06971
(Put_DNA-bind_N)
5 ARG A 168
VAL A 167
ILE A 171
VAL A 138
ILE A 142
None
1.48A 6gsdA-3wghA:
6.8
6gsdA-3wghA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zif PENTON PROTEIN

(Bovine
mastadenovirus
B)
PF01686
(Adeno_Penton_B)
5 PHE M 239
ILE M 262
MET M 173
VAL M 139
CYH M 235
None
1.39A 6gsdA-3zifM:
undetectable
6gsdA-3zifM:
10.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ccd GALACTOCEREBROSIDASE

(Mus musculus)
PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M)
5 VAL A 534
PHE A 579
ILE A 532
ASN A 566
ILE A 572
None
1.25A 6gsdA-4ccdA:
3.0
6gsdA-4ccdA:
9.75
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.
4dqx PROBABLE
OXIDOREDUCTASE
PROTEIN


(Rhizobium etli)
PF13561
(adh_short_C2)
5 VAL A 143
ILE A 144
ASN A 157
VAL A 198
ILE A 196
None
1.35A 6gsdA-4dqxA:
18.2
6gsdA-4dqxA:
13.72
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.
4e4y SHORT CHAIN
DEHYDROGENASE FAMILY
PROTEIN


(Francisella
tularensis)
PF13561
(adh_short_C2)
5 VAL A  59
ILE A  63
SER A  10
VAL A   6
ILE A  30
None
1.43A 6gsdA-4e4yA:
18.1
6gsdA-4e4yA:
15.45
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.
4huh TAIL CONNECTOR
PROTEIN GP15


(Escherichia
virus T4)
PF16724
(T4-gp15_tss)
5 VAL A  39
PHE A  21
ILE A  75
VAL A 134
ILE A 122
None
1.32A 6gsdA-4huhA:
undetectable
6gsdA-4huhA:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ilg A1 CISTRON-SPLICING
FACTOR AAR2


(Saccharomyces
cerevisiae)
PF05282
(AAR2)
5 VAL A   4
ILE A  36
MET A 123
VAL A  43
ILE A  17
None
1.46A 6gsdA-4ilgA:
undetectable
6gsdA-4ilgA:
12.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j75 TRYPTOPHANYL-TRNA
SYNTHETASE


(Plasmodium
falciparum)
PF00579
(tRNA-synt_1b)
5 VAL A 600
ILE A 526
MET A 483
SER A 315
VAL A 516
None
1.21A 6gsdA-4j75A:
2.3
6gsdA-4j75A:
11.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jb3 HALOACID
DEHALOGENASE-LIKE
HYDROLASE


(Bacteroides
thetaiotaomicron)
PF13419
(HAD_2)
5 VAL A 104
ILE A  95
SER A 108
VAL A  12
ILE A  13
None
1.31A 6gsdA-4jb3A:
3.3
6gsdA-4jb3A:
15.77
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.
4k17 LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A


(Mus musculus)
PF13516
(LRR_6)
5 VAL A 580
ILE A 582
MET A 627
SER A 573
ILE A 568
None
1.01A 6gsdA-4k17A:
undetectable
6gsdA-4k17A:
9.55
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.
4kw7 ARSENIC
METHYLTRANSFERASE


(Cyanidioschyzon
sp. 5508)
PF13847
(Methyltransf_31)
5 LYS A 110
VAL A 105
SER A  74
VAL A 170
ILE A 169
None
None
CA  A 401 ( 4.3A)
None
None
1.35A 6gsdA-4kw7A:
4.9
6gsdA-4kw7A:
13.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kyi VIPD

(Legionella
pneumophila)
PF01734
(Patatin)
5 VAL A 124
ILE A 170
ASN A 178
SER A 182
ILE A 168
None
1.49A 6gsdA-4kyiA:
undetectable
6gsdA-4kyiA:
9.92
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.
4lcb CELL DIVISION
PROTEIN CDVC, VPS4


(Acidianus
hospitalis)
PF00004
(AAA)
PF09336
(Vps4_C)
5 ARG A 184
VAL A 238
ILE A 196
VAL A 176
ILE A 179
None
1.26A 6gsdA-4lcbA:
undetectable
6gsdA-4lcbA:
13.08
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.
4m5t ALPHA-CRYSTALLIN B
CHAIN


(Homo sapiens)
PF00011
(HSP20)
5 VAL A 128
ILE A 124
SER A 135
VAL A  77
ILE A  98
None
1.48A 6gsdA-4m5tA:
undetectable
6gsdA-4m5tA:
18.60
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.
4n06 CRISPR-ASSOCIATED
ENDONUCLEASE CAS1 1


(Archaeoglobus
fulgidus)
PF01867
(Cas_Cas1)
5 VAL A 182
PHE A 189
ILE A 183
VAL A 265
ILE A 269
None
1.10A 6gsdA-4n06A:
undetectable
6gsdA-4n06A:
13.47
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.
4nbu 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE


(Bacillus sp.
SG-1)
PF13561
(adh_short_C2)
5 VAL A 128
ASN A 142
MET A 168
VAL A 183
ILE A 181
None
1.33A 6gsdA-4nbuA:
19.0
6gsdA-4nbuA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nmu THIOL-DISULFIDE
OXIDOREDUCTASE RESA


(Bacillus
anthracis)
PF00578
(AhpC-TSA)
5 VAL A  35
ILE A  69
ASN A  14
VAL A  16
ILE A  25
None
1.06A 6gsdA-4nmuA:
2.3
6gsdA-4nmuA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pc9 C4-DICARBOXYLATE
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN, PUTATIVE


(Roseobacter
denitrificans)
PF03480
(DctP)
5 VAL A 121
ILE A 126
SER A 324
VAL A 319
ILE A 318
None
1.50A 6gsdA-4pc9A:
undetectable
6gsdA-4pc9A:
19.53
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.
4pju COHESIN SUBUNIT SA-2

(Homo sapiens)
PF08514
(STAG)
5 ARG A 184
VAL A 183
ILE A 191
ASN A 236
ILE A 281
None
1.42A 6gsdA-4pjuA:
undetectable
6gsdA-4pjuA:
5.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q3n MGS-M5

(unidentified)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 VAL A 104
PHE A 112
ILE A 107
SER A 120
VAL A  76
None
1.38A 6gsdA-4q3nA:
9.4
6gsdA-4q3nA:
14.98
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.
4qyi HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE


(Bacillus
anthracis)
PF00156
(Pribosyltran)
5 VAL A  59
ILE A  35
SER A  44
VAL A  96
ILE A  95
None
1.49A 6gsdA-4qyiA:
3.6
6gsdA-4qyiA:
20.11
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.
4qyj ALDEHYDE
DEHYDROGENASE


(Pseudomonas
putida)
PF00171
(Aldedh)
5 VAL A 452
ILE A 432
ASN A 422
VAL A 418
ILE A 275
None
1.39A 6gsdA-4qyjA:
3.2
6gsdA-4qyjA:
10.08
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.
4ywe PUTATIVE ALDEHYDE
DEHYDROGENASE


(Burkholderia
cenocepacia)
PF00171
(Aldedh)
5 VAL A 433
ILE A 413
ASN A 403
VAL A 399
ILE A 256
None
1.42A 6gsdA-4yweA:
3.4
6gsdA-4yweA:
11.07
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.
4z0z AURONE SYNTHASE

(Coreopsis
grandiflora)
PF00264
(Tyrosinase)
PF12142
(PPO1_DWL)
5 PHE A 108
ILE A 111
SER A 118
TRP A 119
VAL A 231
None
1.36A 6gsdA-4z0zA:
undetectable
6gsdA-4z0zA:
13.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA


(Methanothermobacter
marburgensis)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
5 PHE A 515
ILE A 511
ASN A 279
VAL A 108
ILE A 109
None
1.34A 6gsdA-5a8rA:
undetectable
6gsdA-5a8rA:
8.68
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA


(Methanothermobacter
marburgensis)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
5 PHE A 515
ILE A 511
ASN A 279
VAL A 108
ILE A 264
None
1.21A 6gsdA-5a8rA:
undetectable
6gsdA-5a8rA:
8.68
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.
5fxe EUGENOL OXIDASE

(Rhodococcus
jostii)
PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C)
5 ARG A 290
VAL A 385
ASN A 419
MET A 455
ILE A 445
None
1.43A 6gsdA-5fxeA:
undetectable
6gsdA-5fxeA:
10.36
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.
5gaj DE NOVO DESIGNED
PROTEIN OR258


(synthetic
construct)
no annotation 5 LYS A  37
VAL A  40
ILE A  69
VAL A   8
ILE A   6
None
1.33A 6gsdA-5gajA:
2.6
6gsdA-5gajA:
17.73
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.
5kha GLUTAMINE-DEPENDENT
NAD+ SYNTHETASE


(Acinetobacter
baumannii)
PF00795
(CN_hydrolase)
PF02540
(NAD_synthase)
5 VAL A  75
ILE A  78
SER A  46
VAL A  81
ILE A  40
None
1.36A 6gsdA-5khaA:
undetectable
6gsdA-5khaA:
10.37
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.
5lt1 KINESIN-LIKE PROTEIN

(Homo sapiens)
PF00225
(Kinesin)
5 ARG A 321
PHE A  82
ILE A 298
MET A 282
ILE A   9
None
1.42A 6gsdA-5lt1A:
undetectable
6gsdA-5lt1A:
12.73
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.
5mlh -

(-)
no annotation 11 ARG A 146
LYS A 147
VAL A 150
PHE A 153
ILE A 156
ASN A 205
MET A 215
SER A 248
TRP A 284
VAL A 347
ILE A 350
None
XOG  A 402 ( 2.7A)
None
XOG  A 402 (-3.9A)
None
XOG  A 402 (-2.8A)
XOG  A 402 ( 4.2A)
XOG  A 402 ( 4.6A)
None
XOG  A 402 (-3.6A)
XOG  A 402 (-4.8A)
0.58A 6gsdA-5mlhA:
62.5
6gsdA-5mlhA:
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.
5mlh -

(-)
no annotation 11 ARG A 146
VAL A 150
PHE A 153
ILE A 156
ASN A 205
MET A 215
SER A 248
TRP A 284
VAL A 347
ILE A 350
CYH A 352
None
None
XOG  A 402 (-3.9A)
None
XOG  A 402 (-2.8A)
XOG  A 402 ( 4.2A)
XOG  A 402 ( 4.6A)
None
XOG  A 402 (-3.6A)
XOG  A 402 (-4.8A)
XOG  A 402 (-3.8A)
0.57A 6gsdA-5mlhA:
62.5
6gsdA-5mlhA:
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.
5mqp GLYCOSIDE HYDROLASE
BT_1002


(Bacteroides
thetaiotaomicron)
no annotation 5 VAL A 104
ILE A 317
VAL A  95
ILE A  96
CYH A  68
None
1.19A 6gsdA-5mqpA:
undetectable
6gsdA-5mqpA:
8.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n7z LIPOPOLYSACCHARIDE
1,6-GALACTOSYLTRANSF
ERASE


(Salmonella
enterica)
no annotation 5 PHE A 115
ILE A  91
ASN A 350
SER A  30
ILE A   3
None
1.41A 6gsdA-5n7zA:
5.8
6gsdA-5n7zA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ttk AMINE OXIDASE

(Pseudomonas
putida)
PF01593
(Amino_oxidase)
5 VAL A 396
ILE A 388
MET A 141
SER A 379
ILE A 382
None
0.94A 6gsdA-5ttkA:
3.3
6gsdA-5ttkA:
10.36
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.
5u81 ACID CERAMIDASE
ISOFORM B


(Heterocephalus
glaber)
no annotation 5 VAL A 177
ILE A 178
MET A  94
VAL A  77
ILE A  76
CL  A 417 (-4.4A)
CL  A 417 (-3.9A)
None
None
None
1.34A 6gsdA-5u81A:
undetectable
6gsdA-5u81A:
18.07
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.
5x7s GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE


(Paenibacillus
sp. 598K)
PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF16990
(CBM_35)
PF17137
(DUF5110)
5 VAL A 718
PHE A 721
ILE A 720
VAL A 824
ILE A 782
None
1.43A 6gsdA-5x7sA:
undetectable
6gsdA-5x7sA:
5.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xxu RIBOSOMAL PROTEIN
US15


(Toxoplasma
gondii)
PF00312
(Ribosomal_S15)
PF08069
(Ribosomal_S13_N)
5 VAL N  63
ILE N  71
SER N  57
VAL N  52
ILE N  50
None
U  2 958 ( 4.3A)
None
U  2 957 ( 4.5A)
None
1.29A 6gsdA-5xxuN:
undetectable
6gsdA-5xxuN:
24.24
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.
5y28 -

(-)
no annotation 5 VAL A 126
ILE A  58
SER A 106
VAL A 112
ILE A 151
None
1.44A 6gsdA-5y28A:
undetectable
6gsdA-5y28A:
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.
6b4o GLUTATHIONE
REDUCTASE


(Enterococcus
faecalis)
no annotation 5 VAL A 124
PHE A 116
ILE A 122
VAL A   8
ILE A   7
None
1.44A 6gsdA-6b4oA:
6.4
6gsdA-6b4oA:
11.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fb3 TENEURIN-2

(Gallus gallus)
no annotation 5 VAL A1532
ILE A1518
SER A1475
VAL A1464
ILE A1465
None
1.37A 6gsdA-6fb3A:
undetectable
6gsdA-6fb3A:
12.50