SIMILAR PATTERNS OF AMINO ACIDS FOR 5KOX_A_RFPA502_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1akm ORNITHINE
TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		6 GLY A 285
PHE A 292
GLY A 162
PHE A 270
THR A 301
GLY A 297
 None
 1.42A 5koxA-1akmA:
undetectable		 5koxA-1akmA:
23.05
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.
1b43 PROTEIN (FEN-1)

(Pyrococcus
furiosus) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 GLY A 243
GLY A   5
ILE A   4
GLY A 239
GLY A 240
 None
 0.94A 5koxA-1b43A:
undetectable		 5koxA-1b43A:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dgm ADENOSINE KINASE

(Toxoplasma
gondii) 		PF00294
(PfkB) 		5 PHE A 354
GLY A 111
PHE A 116
GLY A  68
GLY A  69
 None
None
None
ADN  A 375 ( 4.5A)
ADN  A 375 (-2.9A)
 0.83A 5koxA-1dgmA:
undetectable		 5koxA-1dgmA:
23.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ecg GLUTAMINE
PHOSPHORIBOSYLPYROPH
OSPHATE
AMIDOTRANSFERASE

(Escherichia
coli) 		PF00156
(Pribosyltran)
PF13522
(GATase_6) 		5 GLY A 165
ARG A  26
GLY A   2
ILE A   3
GLY A 186
 None
 0.84A 5koxA-1ecgA:
undetectable		 5koxA-1ecgA:
23.44
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.
1eg7 FORMYLTETRAHYDROFOLA
TE SYNTHETASE

(Moorella
thermoacetica) 		PF01268
(FTHFS) 		6 GLY A1106
ARG A1097
GLY A1273
VAL A1201
GLY A1110
GLY A1109
 None
SO4  A   1 (-2.9A)
None
None
None
None
 1.03A 5koxA-1eg7A:
undetectable		 5koxA-1eg7A:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fl2 ALKYL HYDROPEROXIDE
REDUCTASE SUBUNIT F

(Escherichia
coli) 		PF07992
(Pyr_redox_2) 		6 GLY A 271
GLY A 239
VAL A 282
ILE A 217
GLY A 247
GLY A 246
 None
None
None
None
FAD  A 522 (-3.2A)
None
 1.35A 5koxA-1fl2A:
12.3		 5koxA-1fl2A:
23.54
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A 255
VAL A 271
ILE A 301
GLY A  33
GLY A  36
 None
None
None
FAD  A 600 (-3.1A)
None
 0.78A 5koxA-1gpeA:
9.4		 5koxA-1gpeA:
24.84
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.
1jsd HAEMAGGLUTININ (HA1
CHAIN)
HAEMAGGLUTININ (HA2
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 ARG A 312
GLY B   8
VAL A  24
GLY B  13
GLY B  12
 None
 0.91A 5koxA-1jsdA:
undetectable		 5koxA-1jsdA:
21.27
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.
1m33 BIOH PROTEIN

(Escherichia
coli) 		PF00561
(Abhydrolase_1) 		5 GLY A  21
GLY A 119
VAL A 210
ILE A 120
GLY A 179
 3OH  A 300 (-3.6A)
None
None
None
None
 0.95A 5koxA-1m33A:
undetectable		 5koxA-1m33A:
21.94
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.
1mc8 FLAP ENDONUCLEASE-1

(Pyrococcus
horikoshii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 GLY A 244
GLY A   6
ILE A   5
GLY A 240
GLY A 241
 None
 0.90A 5koxA-1mc8A:
undetectable		 5koxA-1mc8A:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mc8 FLAP ENDONUCLEASE-1

(Pyrococcus
horikoshii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 GLY A 244
GLY A   6
ILE A   5
THR A 235
GLY A 241
 None
 0.92A 5koxA-1mc8A:
undetectable		 5koxA-1mc8A:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n2f ORGANIC
HYDROPEROXIDE
RESISTANCE PROTEIN

(Pseudomonas
aeruginosa) 		PF02566
(OsmC) 		5 GLY A  44
GLY A  87
ILE A  88
GLY A  40
GLY A  41
 None
 0.95A 5koxA-1n2fA:
undetectable		 5koxA-1n2fA:
16.47
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.
1og0 PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE

(Saccharomyces
cerevisiae) 		PF00793
(DAHP_synth_1) 		5 GLY A 203
ILE A 278
THR A 255
GLY A 254
GLY A 251
 None
 0.86A 5koxA-1og0A:
undetectable		 5koxA-1og0A:
22.09
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.
1r4y RIBONUCLEASE
ALPHA-SARCIN

(Aspergillus
giganteus) 		no annotation 5 GLY A  44
ARG A 107
ILE A 109
PHE A  57
GLY A  41
 None
 0.89A 5koxA-1r4yA:
undetectable		 5koxA-1r4yA:
13.38
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.
1rii 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Mycobacterium
tuberculosis) 		PF00300
(His_Phos_1) 		5 GLY A 210
ILE A 211
THR A 229
GLY A 228
GLY A 227
 None
 0.92A 5koxA-1riiA:
undetectable		 5koxA-1riiA:
23.12
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.
1rr9 ATP-DEPENDENT
PROTEASE LA

(Escherichia
coli) 		PF05362
(Lon_C) 		5 GLY A 717
GLY A 631
VAL A 633
GLY A 607
GLY A 608
 None
 0.93A 5koxA-1rr9A:
undetectable		 5koxA-1rr9A:
20.38
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.
1sgq STREPTOMYCES GRISEUS
PROTEINASE B

(Streptomyces
griseus) 		PF00089
(Trypsin) 		5 GLY E 193
GLY E 223
THR E 157
GLY E 156
GLY E 140
 None
 0.90A 5koxA-1sgqE:
undetectable		 5koxA-1sgqE:
18.98
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.
1smr RENIN

(Mus musculus) 		PF00026
(Asp) 		5 GLY A 158
GLY A 217
ILE A  30
GLY A 163
GLY A 162
 None
 0.93A 5koxA-1smrA:
undetectable		 5koxA-1smrA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u2e 2-HYDROXY-6-KETONONA
-2,4-DIENEDIOIC ACID
HYDROLASE

(Escherichia
coli) 		PF12697
(Abhydrolase_6) 		5 GLY A 136
GLY A 150
ILE A 151
GLY A 139
GLY A 138
 None
 0.77A 5koxA-1u2eA:
undetectable		 5koxA-1u2eA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wl8 GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG] SUBUNIT A

(Pyrococcus
horikoshii) 		PF00117
(GATase) 		5 GLY A  77
ARG A  95
GLY A  96
GLY A  52
GLY A  51
 None
None
None
None
CL  A1202 ( 3.7A)
 0.90A 5koxA-1wl8A:
undetectable		 5koxA-1wl8A:
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.
1x3l HYPOTHETICAL PROTEIN
PH0495

(Pyrococcus
horikoshii) 		PF05161
(MOFRL)
PF13660
(DUF4147) 		5 GLY A 342
GLY A 305
ILE A 304
GLY A 379
GLY A 378
 None
 0.88A 5koxA-1x3lA:
undetectable		 5koxA-1x3lA:
22.24
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.
1zvd SMAD UBIQUITINATION
REGULATORY FACTOR 2

(Homo sapiens) 		PF00632
(HECT) 		6 ARG A 680
GLY A 502
ILE A 632
PHE A 686
THR A 676
GLY A 677
 None
None
None
None
NA  A 800 (-4.7A)
None
 1.36A 5koxA-1zvdA:
undetectable		 5koxA-1zvdA:
21.40
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.
2c1l RESTRICTION
ENDONUCLEASE

(Bacillus firmus) 		PF13091
(PLDc_2) 		5 GLY A 130
GLY A 110
VAL A 120
GLY A  50
GLY A  49
 TLA  A1363 ( 4.5A)
None
None
None
None
 0.84A 5koxA-2c1lA:
undetectable		 5koxA-2c1lA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e2n HEXOKINASE

(Sulfurisphaera
tokodaii) 		PF01869
(BcrAD_BadFG) 		5 GLY A  66
GLY A 248
THR A  12
GLY A  11
GLY A  10
 None
 0.89A 5koxA-2e2nA:
undetectable		 5koxA-2e2nA:
23.35
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 GLY A 138
GLY A  52
ILE A  51
GLY A 226
GLY A 225
 None
 0.85A 5koxA-2eo5A:
undetectable		 5koxA-2eo5A:
23.90
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.
2g7z CONSERVED
HYPOTHETICAL PROTEIN
SPY1493

(Streptococcus
pyogenes) 		PF02645
(DegV) 		5 GLY A 160
VAL A 188
ILE A 159
GLY A 170
GLY A 171
 None
None
HXA  A9136 ( 4.3A)
GOL  A2647 (-2.9A)
None
 0.95A 5koxA-2g7zA:
undetectable		 5koxA-2g7zA:
19.92
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.
2ipi ACLACINOMYCIN
OXIDOREDUCTASE
(AKNOX)

(Streptomyces
galilaeus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A 195
GLY A 107
PHE A 208
GLY A 143
GLY A 142
 None
None
None
FAD  A 801 (-2.9A)
None
 0.91A 5koxA-2ipiA:
undetectable		 5koxA-2ipiA:
22.95
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.
2iuc ALKALINE PHOSPHATASE

(Antarctic
bacterium TAB5) 		PF00245
(Alk_phosphatase) 		5 GLY B 261
PHE B 307
ILE B 342
GLY B 306
GLY B 305
 None
 0.93A 5koxA-2iucB:
undetectable		 5koxA-2iucB:
22.07
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.
2lxn GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG] SUBUNIT A

(Methanocaldococcus
jannaschii) 		PF00117
(GATase) 		5 GLY A  74
GLY A  91
VAL A 129
GLY A  52
GLY A  51
 None
 0.90A 5koxA-2lxnA:
undetectable		 5koxA-2lxnA:
16.71
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.
2oua SERINE PROTEASE

(Nocardiopsis
alba) 		PF00089
(Trypsin) 		5 GLY A 196
GLY A  84
VAL A  64
GLY A  18
GLY A  19
 None
 0.95A 5koxA-2ouaA:
undetectable		 5koxA-2ouaA:
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.
2pa1 PDZ AND LIM DOMAIN
PROTEIN 2

(Homo sapiens) 		PF00595
(PDZ) 		6 GLY A  59
ARG A  70
ILE A  69
THR A  18
GLY A  19
GLY A  20
 None
 1.29A 5koxA-2pa1A:
undetectable		 5koxA-2pa1A:
12.83
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.
2pcs CONSERVED PROTEIN

(Geobacillus
kaustophilus) 		PF06240
(COXG) 		5 GLY A 121
GLY A  51
ILE A  50
GLY A 127
GLY A 126
 None
None
UNL  A 161 ( 4.8A)
None
None
 0.89A 5koxA-2pcsA:
undetectable		 5koxA-2pcsA:
13.70
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.
2ppy ENOYL-COA HYDRATASE

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		5 GLY A 147
ILE A  97
PHE A  40
GLY A 116
GLY A 115
 None
 0.83A 5koxA-2ppyA:
undetectable		 5koxA-2ppyA:
20.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qa1 POLYKETIDE OXYGENASE
PGAE

(Streptomyces
sp. PGA64) 		PF01494
(FAD_binding_3) 		5 GLY A  45
ILE A 212
PHE A 255
GLY A 284
GLY A 285
 None
None
FAD  A 500 ( 4.3A)
EDO  A 602 (-3.3A)
FAD  A 500 ( 3.2A)
 0.79A 5koxA-2qa1A:
52.4		 5koxA-2qa1A:
44.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qa2 POLYKETIDE OXYGENASE
CABE

(Streptomyces) 		PF01494
(FAD_binding_3) 		5 GLY A  45
ILE A 212
PHE A 255
GLY A 284
GLY A 285
 None
None
FAD  A 500 ( 4.5A)
None
FAD  A 500 (-3.1A)
 0.64A 5koxA-2qa2A:
53.7		 5koxA-2qa2A:
42.91
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.
2wed PENICILLOPEPSIN

(Penicillium
janthinellum) 		PF00026
(Asp) 		5 GLY A  63
GLY A 120
THR A  22
GLY A  25
GLY A  24
 None
 0.94A 5koxA-2wedA:
undetectable		 5koxA-2wedA:
19.96
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		6 GLY A  87
PHE A 148
GLY A 143
VAL A 278
THR A 151
GLY A 149
 None
 1.44A 5koxA-2wtbA:
undetectable		 5koxA-2wtbA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y2w ARABINOFURANOSIDASE

(Bifidobacterium
longum) 		PF06964
(Alpha-L-AF_C) 		6 GLY A 104
GLY A  78
VAL A  96
ILE A  79
PHE A 152
GLY A  65
 None
 1.20A 5koxA-2y2wA:
undetectable		 5koxA-2y2wA:
21.70
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.
3cea MYO-INOSITOL
2-DEHYDROGENASE

(Lactobacillus
plantarum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		6 ARG A 131
PHE A 297
GLY A 265
VAL A 251
ILE A 264
PHE A 196
 None
 1.27A 5koxA-3ceaA:
undetectable		 5koxA-3ceaA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cqo FBP32

(Morone
saxatilis) 		PF00754
(F5_F8_type_C) 		6 GLY A  94
VAL A 141
ILE A  66
PHE A 116
GLY A 122
GLY A  87
 None
 1.39A 5koxA-3cqoA:
undetectable		 5koxA-3cqoA:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ezl ACETOACETYL-COA
REDUCTASE

(Burkholderia
pseudomallei) 		PF00106
(adh_short) 		5 VAL A  81
ILE A  84
THR A  11
GLY A  12
GLY A  13
 None
None
P4C  A 249 ( 4.7A)
P4C  A 249 (-3.7A)
None
 0.92A 5koxA-3ezlA:
4.4		 5koxA-3ezlA:
23.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f7o SERINE PROTEASE

(Purpureocillium
lilacinum) 		PF00082
(Peptidase_S8) 		5 GLY A  95
PHE A 116
GLY A 155
VAL A 130
GLY A 113
 None
 0.95A 5koxA-3f7oA:
undetectable		 5koxA-3f7oA:
20.92
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.
3hd6 AMMONIUM TRANSPORTER
RH TYPE C

(Homo sapiens) 		PF00909
(Ammonium_transp) 		5 GLY A 339
GLY A 180
VAL A 291
ILE A 184
GLY A 192
 None
 0.95A 5koxA-3hd6A:
undetectable		 5koxA-3hd6A:
22.74
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.
3i7j BETA-LACTAMASE
MB2281C

(Mycobacterium
bovis) 		PF00144
(Beta-lactamase) 		5 GLY A 253
PHE A 227
ILE A 263
GLY A 232
GLY A 231
 None
 0.92A 5koxA-3i7jA:
undetectable		 5koxA-3i7jA:
22.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ihg RDME

(Streptomyces
purpurascens) 		PF01494
(FAD_binding_3) 		5 GLY A  48
GLY A 204
THR A 316
GLY A 317
GLY A 318
 VAK  A 537 ( 4.6A)
None
VAK  A 537 (-4.2A)
VAK  A 537 (-3.0A)
VAK  A 537 (-3.2A)
 0.88A 5koxA-3ihgA:
34.2		 5koxA-3ihgA:
33.51
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.
3k8z NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A 113
ILE A 141
PHE A 181
GLY A  81
GLY A  80
 None
 0.92A 5koxA-3k8zA:
undetectable		 5koxA-3k8zA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k92 NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A 114
ILE A 142
PHE A 182
GLY A  82
GLY A  81
 None
 0.95A 5koxA-3k92A:
undetectable		 5koxA-3k92A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l0z PUTATIVE
NICOTINATE-NUCLEOTID
E-DIMETHYLBENZIMIDAZ
OLE
PHOSPHORIBOSYLTRANSF
ERASE

(Methanocaldococcus
jannaschii) 		PF02277
(DBI_PRT) 		5 GLY A  39
GLY A 172
THR A 158
GLY A 155
GLY A 154
 PO4  A 351 (-4.4A)
None
None
PO4  A 351 (-4.2A)
PO4  A 351 (-3.0A)
 0.94A 5koxA-3l0zA:
undetectable		 5koxA-3l0zA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3no4 CREATININE
AMIDOHYDROLASE

(Nostoc
punctiforme) 		PF02633
(Creatininase) 		5 GLY A  66
GLY A  32
PHE A 205
GLY A 111
GLY A 112
 None
None
None
UNL  A 350 ( 4.5A)
UNL  A 350 ( 4.6A)
 0.92A 5koxA-3no4A:
undetectable		 5koxA-3no4A:
22.08
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.
3nyw PUTATIVE
OXIDOREDUCTASE

(Bacteroides
thetaiotaomicron) 		PF00106
(adh_short) 		5 GLY A   6
GLY A  18
ILE A  21
THR A  27
GLY A  29
 None
 0.85A 5koxA-3nywA:
3.8		 5koxA-3nywA:
19.71
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.
3omn CYTOCHROME C
OXIDASE, AA3 TYPE,
SUBUNIT I

(Rhodobacter
sphaeroides) 		PF00115
(COX1) 		5 GLY A 360
GLY A 431
VAL A 298
GLY A 394
GLY A 395
 HEA  A   2 (-1.8A)
None
None
None
HEA  A   2 (-3.4A)
 0.81A 5koxA-3omnA:
undetectable		 5koxA-3omnA:
22.98
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.
3p2m POSSIBLE HYDROLASE

(Mycobacterium
tuberculosis) 		PF12697
(Abhydrolase_6) 		5 GLY A 157
GLY A 281
VAL A 283
GLY A  90
GLY A  89
 None
 0.95A 5koxA-3p2mA:
undetectable		 5koxA-3p2mA:
23.37
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.
3pop GILR OXIDASE

(Streptomyces
griseoflavus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A 190
GLY A 102
PHE A 203
GLY A 138
GLY A 137
 None
None
None
FAD  A 499 (-3.5A)
None
 0.84A 5koxA-3popA:
undetectable		 5koxA-3popA:
25.00
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.
3qfk UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 GLY A 230
PHE A 227
ILE A 119
PHE A  96
GLY A  55
 None
 0.95A 5koxA-3qfkA:
undetectable		 5koxA-3qfkA:
20.94
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.
3qum PROSTATE-SPECIFIC
ANTIGEN

(Homo sapiens) 		PF00089
(Trypsin) 		5 GLY P 140
PHE P 149
ILE P  65
GLY P 196
GLY P 197
 None
 0.88A 5koxA-3qumP:
undetectable		 5koxA-3qumP:
19.13
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.
3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE

(Klebsiella
pneumoniae) 		PF05035
(DGOK) 		5 GLY A  68
ARG A  41
GLY A  40
THR A  13
GLY A  11
 None
 0.87A 5koxA-3r1xA:
undetectable		 5koxA-3r1xA:
22.22
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.
3sti PROTEASE DEGQ

(Escherichia
coli) 		PF13365
(Trypsin_2) 		5 GLY A 149
GLY A  75
VAL A  77
ILE A 118
GLY A  97
 None
 0.87A 5koxA-3stiA:
undetectable		 5koxA-3stiA:
20.68
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.
3tbb SMALL LACCASE,
OXIDOREDUCTASE

(Streptomyces
viridosporus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A  59
VAL A 189
THR A 161
GLY A 162
GLY A 163
 None
 0.95A 5koxA-3tbbA:
undetectable		 5koxA-3tbbA:
22.47
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.
3uet ALPHA-1,3/4-FUCOSIDA
SE

(Bifidobacterium
longum) 		PF01120
(Alpha_L_fucos) 		5 GLY A 342
ARG A 444
GLY A 315
GLY A  75
GLY A  74
 None
 0.77A 5koxA-3uetA:
undetectable		 5koxA-3uetA:
24.54
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.
3vpx LEUCINE
DEHYDROGENASE

(Sporosarcina
psychrophila) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A  78
ILE A  28
THR A  43
GLY A  42
GLY A  41
 None
 0.95A 5koxA-3vpxA:
undetectable		 5koxA-3vpxA:
21.81
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.
3vte TETRAHYDROCANNABINOL
IC ACID SYNTHASE

(Cannabis sativa) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A 191
VAL A 249
ILE A 246
GLY A 188
GLY A 189
 None
None
None
None
FAD  A 607 (-3.5A)
 0.81A 5koxA-3vteA:
undetectable		 5koxA-3vteA:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wmr PROLINE
IMINOPEPTIDASE

(Streptomyces
halstedii) 		PF00561
(Abhydrolase_1) 		5 GLY A  39
GLY A 247
ILE A 246
GLY A 108
GLY A 112
 None
 0.92A 5koxA-3wmrA:
undetectable		 5koxA-3wmrA:
22.84
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.
3zdn MONOAMINE OXIDASE N

(Aspergillus
niger) 		PF01593
(Amino_oxidase) 		6 GLY A 430
GLY A 436
VAL A 438
THR A 218
GLY A 217
GLY A 216
 FAD  A1487 ( 4.1A)
None
None
None
None
None
 1.46A 5koxA-3zdnA:
10.8		 5koxA-3zdnA:
22.86
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD

(Pseudomonas
aeruginosa) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLY A 211
GLY A 145
VAL A 263
ILE A 146
GLY A 166
 None
 0.78A 5koxA-4a5oA:
undetectable		 5koxA-4a5oA:
23.09
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.
4aoy ISOCITRATE
DEHYDROGENASE [NADP]

(Ruminiclostridium
thermocellum) 		PF00180
(Iso_dh) 		5 ARG A 340
GLY A  70
GLY A 345
ILE A 346
GLY A 335
 None
 0.94A 5koxA-4aoyA:
undetectable		 5koxA-4aoyA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4at0 3-KETOSTEROID-DELTA4
-5ALPHA-DEHYDROGENAS
E

(Rhodococcus
jostii) 		PF00890
(FAD_binding_2) 		5 GLY A 176
GLY A 475
ILE A  31
GLY A 180
GLY A 179
 None
None
FAD  A1493 (-4.6A)
None
None
 0.94A 5koxA-4at0A:
14.0		 5koxA-4at0A:
25.54
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.
4ecf ABC-TYPE PHOSPHATE
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Lactobacillus
brevis) 		PF12849
(PBP_like_2) 		5 GLY A  96
ILE A  97
THR A  70
GLY A  69
GLY A  39
 None
None
PO4  A 300 (-3.6A)
PO4  A 300 (-3.4A)
None
 0.82A 5koxA-4ecfA:
undetectable		 5koxA-4ecfA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hgv FUMARATE HYDRATASE
CLASS II

(Sinorhizobium
meliloti) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLY A 133
VAL A 144
ILE A  79
GLY A 129
GLY A 130
 None
 0.94A 5koxA-4hgvA:
undetectable		 5koxA-4hgvA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ipa PUTATIVE CURVED
DNA-BINDING PROTEIN

(Chaetomium
thermophilum) 		PF00557
(Peptidase_M24) 		5 GLY A 347
ILE A 348
THR A 340
GLY A 352
GLY A 353
 None
 0.91A 5koxA-4ipaA:
undetectable		 5koxA-4ipaA:
21.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4k5r OXYGENASE

(Streptomyces
argillaceus) 		PF01494
(FAD_binding_3) 		5 GLY A  19
GLY A 177
ILE A 178
GLY A 168
GLY A 167
 FAD  A 601 (-3.4A)
None
None
None
FAD  A 601 (-3.6A)
 0.91A 5koxA-4k5rA:
53.4		 5koxA-4k5rA:
45.40
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.
4ldc DOUBLE C2-LIKE
DOMAIN-CONTAINING
PROTEIN BETA

(Rattus
norvegicus) 		PF00168
(C2) 		6 GLY A 268
GLY A 286
ILE A 287
THR A 354
GLY A 369
GLY A 368
 None
 1.10A 5koxA-4ldcA:
undetectable		 5koxA-4ldcA:
15.12
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.
4ng4 PHOSPHOGLYCERATE
KINASE

(Coxiella
burnetii) 		PF00162
(PGK) 		5 GLY A 349
ARG A  65
GLY A  64
GLY A 372
GLY A 371
 ADP  A 402 (-4.0A)
None
None
None
None
 0.90A 5koxA-4ng4A:
undetectable		 5koxA-4ng4A:
21.69
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.
4nmw PIMELYL-[ACYL-CARRIE
R PROTEIN] METHYL
ESTER ESTERASE

(Salmonella
enterica) 		PF00561
(Abhydrolase_1) 		5 GLY A  21
GLY A 119
VAL A 210
ILE A 120
GLY A 179
 CL  A 301 ( 4.0A)
None
None
None
None
 0.94A 5koxA-4nmwA:
undetectable		 5koxA-4nmwA:
22.22
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.
4p6v NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT C
NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT D

(Vibrio cholerae) 		PF02508
(Rnf-Nqr)
PF04205
(FMN_bind) 		5 ARG D 152
GLY D 149
THR C 173
GLY C 177
GLY C 178
 None
None
FMN  C 301 (-3.2A)
FMN  C 301 ( 3.8A)
None
 0.93A 5koxA-4p6vD:
undetectable		 5koxA-4p6vD:
17.86
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.
4phb UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		PF14262
(Cthe_2159) 		5 GLY A 184
GLY A 216
ILE A 217
GLY A 235
GLY A 205
 None
 0.93A 5koxA-4phbA:
undetectable		 5koxA-4phbA:
19.25
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.
4pka PATATIN-17

(Solanum
cardiophyllum) 		PF01734
(Patatin) 		6 GLY X  38
PHE X 194
VAL X 133
THR X  83
GLY X  80
GLY X  79
 MIS  X  77 ( 3.4A)
MIS  X  77 ( 4.6A)
None
None
MIS  X  77 ( 3.2A)
MIS  X  77 ( 4.1A)
 1.29A 5koxA-4pkaX:
undetectable		 5koxA-4pkaX:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tm3 KTZI

(Kutzneria sp.
744) 		PF13434
(K_oxygenase) 		5 PHE A 257
GLY A 387
ILE A 388
GLY A 392
GLY A 393
 None
 0.76A 5koxA-4tm3A:
4.4		 5koxA-4tm3A:
24.37
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		5 PHE A  63
GLY A  99
ILE A  98
THR A  58
GLY A  59
 None
 0.94A 5koxA-4w5kA:
undetectable		 5koxA-4w5kA:
23.91
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.
4wd1 ACETOACETATE-COA
LIGASE

(Streptomyces
lividans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		5 GLY A 288
ILE A 289
THR A 424
GLY A 423
GLY A 422
 None
 0.68A 5koxA-4wd1A:
undetectable		 5koxA-4wd1A:
25.55
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.
4xjc DEOXYCYTIDINE
TRIPHOSPHATE
DEAMINASE

(Bacillus
halodurans) 		PF00692
(dUTPase) 		5 GLY A  97
VAL A 101
ILE A 108
THR A  80
GLY A  37
 None
 0.81A 5koxA-4xjcA:
undetectable		 5koxA-4xjcA:
15.93
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.
4xvg ALKYL HYDROPEROXIDE
REDUCTASE SUBUNIT F

(Escherichia
coli) 		PF07992
(Pyr_redox_2)
PF13192
(Thioredoxin_3) 		6 GLY A 271
GLY A 239
VAL A 282
ILE A 217
GLY A 247
GLY A 246
 None
None
None
None
FAD  A 700 (-3.2A)
None
 1.40A 5koxA-4xvgA:
12.3		 5koxA-4xvgA:
25.09
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.
5a4j FORMATE--TETRAHYDROF
OLATE LIGASE

(Tepidanaerobacter
acetatoxydans) 		PF01268
(FTHFS) 		6 GLY A 105
ARG A  96
GLY A 272
VAL A 200
GLY A 109
GLY A 108
 None
EDO  A1560 (-3.0A)
None
None
None
None
 1.11A 5koxA-5a4jA:
undetectable		 5koxA-5a4jA:
23.60
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.
5a5g FORMATE--TETRAHYDROF
OLATE LIGASE

(Tepidanaerobacter
acetatoxydans) 		PF01268
(FTHFS) 		6 GLY A 104
ARG A  95
GLY A 271
VAL A 199
GLY A 108
GLY A 107
 None
 1.11A 5koxA-5a5gA:
undetectable		 5koxA-5a5gA:
24.75
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.
5d6b FUMARATE HYDRATASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLY A 170
VAL A 181
ILE A 116
GLY A 166
GLY A 167
 None
 0.94A 5koxA-5d6bA:
undetectable		 5koxA-5d6bA:
22.99
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.
5e7s LON PROTEASE

(Meiothermus
taiwanensis) 		PF05362
(Lon_C) 		5 GLY A 716
GLY A 630
VAL A 632
THR A 608
GLY A 607
 None
 0.94A 5koxA-5e7sA:
undetectable		 5koxA-5e7sA:
22.47
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.
5elz TYPE II PANTOTHENATE
KINASE

(Staphylococcus
aureus) 		PF03630
(Fumble) 		5 GLY A 201
GLY A 254
THR A  99
GLY A 121
GLY A 120
 None
None
ADP  A 301 ( 3.4A)
ADP  A 301 (-3.2A)
None
 0.80A 5koxA-5elzA:
undetectable		 5koxA-5elzA:
23.01
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.
5fyd OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Collinsella
aerofaciens) 		PF00106
(adh_short) 		5 GLY A  57
GLY A  21
ILE A  13
GLY A  31
GLY A  32
 None
 0.83A 5koxA-5fydA:
2.8		 5koxA-5fydA:
19.57
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.
5gq0 EPITHIOSPECIFIER
PROTEIN

(Arabidopsis
thaliana) 		no annotation 5 GLY B 150
PHE B 158
THR B 129
GLY B  93
GLY B  92
 None
 0.93A 5koxA-5gq0B:
undetectable		 5koxA-5gq0B:
22.09
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.
5i1w CRMK

(Actinoalloteichus
sp. WH1-2216-6) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 GLY A  66
GLY A 332
ILE A 336
GLY A  62
GLY A  63
 67L  A 602 (-3.5A)
None
None
FAD  A 601 (-3.2A)
FAD  A 601 (-3.5A)
 0.88A 5koxA-5i1wA:
undetectable		 5koxA-5i1wA:
24.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ijl DNA POLYMERASE II
LARGE SUBUNIT

(Pyrococcus
abyssi) 		PF03833
(PolC_DP2) 		5 ARG A 351
GLY A 437
ILE A 649
GLY A 348
GLY A 349
 None
 0.94A 5koxA-5ijlA:
undetectable		 5koxA-5ijlA:
19.94
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.
5mdx PHOTOSYSTEM II CP43
REACTION CENTER
PROTEIN
PHOTOSYSTEM II
PROTEIN D1

(Arabidopsis
thaliana) 		PF00124
(Photo_RC)
PF00421
(PSII) 		5 GLY A  90
PHE C 218
VAL A 116
PHE A 182
GLY A 164
 None
 0.94A 5koxA-5mdxA:
undetectable		 5koxA-5mdxA:
22.22
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 6 GLY B 873
ARG B 298
GLY B 297
THR B 898
GLY B 897
GLY B 890
 None
 1.44A 5koxA-5nd1B:
undetectable		 5koxA-5nd1B:
12.03
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 5 GLY A 251
VAL A 267
ILE A 297
GLY A  28
GLY A  31
 None
None
None
FAD  A 601 (-3.2A)
None
 0.81A 5koxA-5nitA:
8.3		 5koxA-5nitA:
24.87
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.
5x7h CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Paenibacillus
sp. 598K) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		5 GLY A 133
ILE A 125
PHE A 109
THR A  78
GLY A  77
 None
 0.85A 5koxA-5x7hA:
undetectable		 5koxA-5x7hA:
21.72
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.
6bfu SPIKE PROTEIN

(Coronavirus
HKU15) 		no annotation 5 GLY A 280
GLY A 552
ILE A 542
PHE A 521
GLY A 499
 None
 0.90A 5koxA-6bfuA:
undetectable		 5koxA-6bfuA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6brd RIFAMPIN
MONOOXYGENASE

(Streptomyces
venezuelae) 		no annotation 8 GLY A  44
PHE A  74
ARG A 196
GLY A 203
PHE A 257
THR A 285
GLY A 286
GLY A 287
 RFP  A 502 ( 4.4A)
RFP  A 502 (-4.5A)
RFP  A 502 (-3.4A)
RFP  A 502 ( 4.7A)
FAD  A 501 (-4.3A)
RFP  A 502 (-4.1A)
RFP  A 502 (-3.5A)
FAD  A 501 (-3.3A)
 0.60A 5koxA-6brdA:
63.4		 5koxA-6brdA:
12.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 6 ARG A  43
GLY A  44
PHE A  69
PHE A  74
GLY A 203
VAL A 205
 RFH  A 502 ( 3.6A)
RFH  A 502 ( 4.7A)
RFH  A 502 ( 4.8A)
RFH  A 502 (-3.4A)
RFH  A 502 (-3.6A)
None
 1.39A 5koxA-6c7sA:
68.4		 5koxA-6c7sA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 11 GLY A  44
PHE A  69
PHE A  74
ARG A 196
GLY A 203
VAL A 205
ILE A 215
PHE A 256
THR A 284
GLY A 285
GLY A 286
 RFH  A 502 ( 4.7A)
RFH  A 502 ( 4.8A)
RFH  A 502 (-3.4A)
RFH  A 502 (-3.1A)
RFH  A 502 (-3.6A)
None
RFH  A 502 (-3.7A)
RFH  A 502 (-4.4A)
RFH  A 502 (-4.0A)
RFH  A 502 (-3.4A)
FAD  A 501 ( 3.3A)
 0.43A 5koxA-6c7sA:
68.4		 5koxA-6c7sA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 9 PHE A  69
PHE A  74
ARG A 196
GLY A 203
VAL A 205
ILE A 215
PHE A 256
THR A 284
GLY A 285
 RFH  A 502 ( 4.8A)
RFH  A 502 (-3.4A)
RFH  A 502 (-3.1A)
RFH  A 502 (-3.6A)
None
RFH  A 502 (-3.7A)
RFH  A 502 (-4.4A)
RFH  A 502 (-4.0A)
RFH  A 502 (-3.4A)
 1.09A 5koxA-6c7sA:
68.4		 5koxA-6c7sA:
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.
6f5o POLYMERASE ACIDIC
PROTEIN
RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza B
virus) 		no annotation 5 GLY B 487
GLY B 461
ILE B 462
PHE A 677
GLY A 673
 None
 0.93A 5koxA-6f5oB:
3.1		 5koxA-6f5oB:
9.64