SIMILAR PATTERNS OF AMINO ACIDS FOR 4L7I_B_SAMB501_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.
1a88 CHLOROPEROXIDASE L

(Streptomyces
lividans) 		PF00561
(Abhydrolase_1) 		4 ASP A  55
LYS A  14
ALA A  53
SER A  33
 None
 1.07A 4l7iB-1a88A:
undetectable		 4l7iB-1a88A:
21.55
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.
1aso ASCORBATE OXIDASE

(Cucurbita pepo) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASP A 255
ALA A 226
TYR A 257
SER A 323
 None
 1.07A 4l7iB-1asoA:
undetectable		 4l7iB-1asoA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bqg D-GLUCARATE
DEHYDRATASE

(Pseudomonas
putida) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 HIS A 321
PRO A 320
ASP A 319
SER A 344
 None
 1.04A 4l7iB-1bqgA:
undetectable		 4l7iB-1bqgA:
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.
1dct PROTEIN
(MODIFICATION
METHYLASE HAEIII)

(Haemophilus
influenzae) 		PF00145
(DNA_methylase) 		4 ASP A  14
ALA A  44
TYR A  38
SER A   8
 None
 1.05A 4l7iB-1dctA:
undetectable		 4l7iB-1dctA:
23.68
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.
1iip CYCLOPHILIN 40

(Bos taurus) 		PF00160
(Pro_isomerase)
PF13176
(TPR_7) 		4 PRO A 194
ASP A 196
SER A 198
ASP A 200
 None
 1.03A 4l7iB-1iipA:
undetectable		 4l7iB-1iipA:
22.77
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.
1iqr PHOTOLYASE

(Thermus
thermophilus) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		4 PRO A 122
ALA A 227
SER A 222
ASP A  16
 None
 0.88A 4l7iB-1iqrA:
undetectable		 4l7iB-1iqrA:
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.
1jct GLUCARATE
DEHYDRATASE

(Escherichia
coli) 		PF13378
(MR_MLE_C) 		4 HIS A 315
PRO A 314
ASP A 313
SER A 338
 None
 1.04A 4l7iB-1jctA:
undetectable		 4l7iB-1jctA:
24.45
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.
1m53 ISOMALTULOSE
SYNTHASE

(Klebsiella sp.
LX3) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PRO A  99
ASP A 106
ALA A 206
SER A 147
 None
 1.02A 4l7iB-1m53A:
undetectable		 4l7iB-1m53A:
21.10
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.
1sml PROTEIN
(PENICILLINASE)

(Stenotrophomonas
maltophilia) 		PF00753
(Lactamase_B) 		4 HIS A  89
ASP A  53
TYR A 182
SER A  83
 ZN  A 270 (-3.2A)
None
None
None
 1.06A 4l7iB-1smlA:
undetectable		 4l7iB-1smlA:
19.34
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.
1szq 2-METHYLCITRATE
DEHYDRATASE

(Escherichia
coli) 		PF03972
(MmgE_PrpD) 		4 HIS A 171
ASP A 170
ALA A 224
TYR A 211
 None
 1.04A 4l7iB-1szqA:
undetectable		 4l7iB-1szqA:
21.80
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.
1wlh GELATION FACTOR

(Dictyostelium
discoideum) 		PF00630
(Filamin) 		4 ASP A 689
ALA A 676
TYR A 715
ASP A 686
 None
 1.03A 4l7iB-1wlhA:
undetectable		 4l7iB-1wlhA:
24.71
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.
1xrc S-ADENOSYLMETHIONINE
SYNTHETASE

(Escherichia
coli) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  14
PRO A  15
ASP A 163
LYS A 165
ASP A 238
 None
 0.48A 4l7iB-1xrcA:
27.1		 4l7iB-1xrcA:
25.37
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.
1y7e PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Borreliella
burgdorferi) 		PF02127
(Peptidase_M18) 		5 HIS A  95
ASP A  97
LYS A 285
TYR A 122
ASP A 255
 None
 1.27A 4l7iB-1y7eA:
undetectable		 4l7iB-1y7eA:
22.68
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.
1yix DEOXYRIBONUCLEASE
YCFH

(Escherichia
coli) 		PF01026
(TatD_DNase) 		4 HIS A 214
PRO A 213
ASP A 226
ALA A 222
 None
 0.96A 4l7iB-1yixA:
undetectable		 4l7iB-1yixA:
22.17
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.
1zy9 ALPHA-GALACTOSIDASE

(Thermotoga
maritima) 		PF02065
(Melibiase) 		4 HIS A 122
PRO A 123
ALA A 333
SER A 118
 None
 0.74A 4l7iB-1zy9A:
undetectable		 4l7iB-1zy9A:
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.
2d1g ACID PHOSPHATASE

(Francisella
tularensis) 		PF04185
(Phosphoesterase) 		5 HIS A 106
PRO A 174
ASP A 387
SER A 175
ASP A 208
 VO4  A 801 (-3.8A)
VO4  A 801 (-4.1A)
UNX  A 601 ( 2.6A)
UNX  A 601 ( 1.8A)
VO4  A 801 (-2.6A)
 1.44A 4l7iB-2d1gA:
undetectable		 4l7iB-2d1gA:
22.11
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.
2e66 DIVALENT-CATION
TOLERANCE PROTEIN
CUTA

(Pyrococcus
horikoshii) 		PF03091
(CutA1) 		4 HIS A  73
PRO A  74
ALA A  53
SER A  13
 None
 0.86A 4l7iB-2e66A:
undetectable		 4l7iB-2e66A:
14.46
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.
2gmn METALLO-BETA-LACTAMA
SE

(Bradyrhizobium
diazoefficiens) 		PF00753
(Lactamase_B) 		4 HIS A 242
PRO A 241
ALA A 206
SER A 202
 ZN  A 802 (-3.2A)
None
None
None
 1.07A 4l7iB-2gmnA:
undetectable		 4l7iB-2gmnA:
22.14
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.
2j3s FILAMIN-A

(Homo sapiens) 		PF00630
(Filamin) 		4 HIS A2315
PRO A2320
LYS A2310
ALA A2272
 None
 0.95A 4l7iB-2j3sA:
undetectable		 4l7iB-2j3sA:
22.44
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.
2o0m TRANSCRIPTIONAL
REGULATOR, SORC
FAMILY

(Enterococcus
faecalis) 		PF04198
(Sugar-bind) 		4 ASP A 332
ALA A 307
SER A 117
ASP A 118
 None
 0.97A 4l7iB-2o0mA:
undetectable		 4l7iB-2o0mA:
24.71
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.
2obv S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-1

(Homo sapiens) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  29
PRO A  30
ASP A 179
LYS A 181
ASP A 258
 SAM  A 501 (-3.6A)
SAM  A 501 (-4.2A)
SAM  A 501 (-2.7A)
SAM  A 501 (-3.9A)
SAM  A 501 (-3.6A)
 0.32A 4l7iB-2obvA:
26.5		 4l7iB-2obvA:
22.42
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.
2q17 FORMYLGLYCINE
GENERATING ENZYME

(Streptomyces
coelicolor) 		PF03781
(FGE-sulfatase) 		4 HIS A 255
ASP A 239
ALA A 164
SER A 238
 None
 0.89A 4l7iB-2q17A:
undetectable		 4l7iB-2q17A:
19.82
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.
2w0p FILAMIN-A

(Homo sapiens) 		PF00630
(Filamin) 		4 HIS A2315
PRO A2320
LYS A2310
ALA A2272
 None
 0.96A 4l7iB-2w0pA:
undetectable		 4l7iB-2w0pA:
12.53
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.
2xy4 ZINC ABC
TRANSPORTER,
PERIPLASMIC
ZINC-BINDING PROTEIN

(Salmonella
enterica) 		PF01297
(ZnuA) 		4 PRO A 261
ALA A 213
TYR A 214
ASP A 283
 None
ZN  A 401 ( 4.7A)
None
None
 0.98A 4l7iB-2xy4A:
undetectable		 4l7iB-2xy4A:
22.00
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.
3bxh CENTRAL GLYCOLYTIC
GENE REGULATOR

(Bacillus
subtilis) 		PF04198
(Sugar-bind) 		4 ASP A 329
ALA A 305
SER A 117
ASP A 118
 None
 1.00A 4l7iB-3bxhA:
undetectable		 4l7iB-3bxhA:
22.87
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.
3c8c METHYL-ACCEPTING
CHEMOTAXIS PROTEIN

(Vibrio cholerae) 		PF02743
(dCache_1) 		4 ASP A 273
ALA A  82
SER A 272
ASP A  75
 None
 1.08A 4l7iB-3c8cA:
undetectable		 4l7iB-3c8cA:
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.
3d45 POLY(A)-SPECIFIC
RIBONUCLEASE PARN

(Mus musculus) 		PF01424
(R3H)
PF04857
(CAF1)
PF08675
(RNA_bind) 		4 HIS A 439
PRO A 481
ASP A 438
LYS A 436
 None
 0.97A 4l7iB-3d45A:
undetectable		 4l7iB-3d45A:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g7x FEMALE-SPECIFIC
HISTAMINE-BINDING
PROTEIN 2

(Rhipicephalus
appendiculatus) 		PF02098
(His_binding) 		4 LYS A  19
ALA A  23
TYR A  29
ASP A 116
 None
 1.00A 4l7iB-3g7xA:
undetectable		 4l7iB-3g7xA:
19.40
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.
3gb4 DDMC

(Stenotrophomonas
maltophilia) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 PRO A  55
ASP A  47
SER A  57
ASP A  58
 None
 0.97A 4l7iB-3gb4A:
undetectable		 4l7iB-3gb4A:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PRO A  72
ASP A  79
ALA A 179
SER A 120
 None
 0.98A 4l7iB-3gbdA:
undetectable		 4l7iB-3gbdA:
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.
3ij6 UNCHARACTERIZED
METAL-DEPENDENT
HYDROLASE

(Lactobacillus
acidophilus) 		PF04909
(Amidohydro_2) 		4 HIS A 225
ASP A 228
LYS A 224
ASP A 191
 None
 0.93A 4l7iB-3ij6A:
undetectable		 4l7iB-3ij6A:
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.
3iml S-ADENOSYLMETHIONINE
SYNTHETASE

(Burkholderia
pseudomallei) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 HIS A  16
PRO A  17
ASP A 167
LYS A 169
 None
 0.28A 4l7iB-3imlA:
26.7		 4l7iB-3imlA:
24.67
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.
3iml S-ADENOSYLMETHIONINE
SYNTHETASE

(Burkholderia
pseudomallei) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 HIS A  16
PRO A  17
LYS A 169
ASP A 242
 None
 0.95A 4l7iB-3imlA:
26.7		 4l7iB-3imlA:
24.67
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.
3ly9 TRANSCRIPTIONAL
ACTIVATOR CADC

(Escherichia
coli) 		no annotation 4 HIS A 240
ASP A 200
SER A 253
ASP A 198
 None
 1.08A 4l7iB-3ly9A:
undetectable		 4l7iB-3ly9A:
22.00
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.
3nxl GLUCARATE
DEHYDRATASE

(Burkholderia
lata) 		PF13378
(MR_MLE_C) 		4 HIS A 335
PRO A 334
ASP A 333
SER A 358
 None
 1.05A 4l7iB-3nxlA:
undetectable		 4l7iB-3nxlA:
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.
3obk DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Toxoplasma
gondii) 		PF00490
(ALAD) 		4 ASP A 242
LYS A 237
ALA A 215
SER A 244
 None
 0.95A 4l7iB-3obkA:
undetectable		 4l7iB-3obkA:
21.89
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.
3p0w MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Ralstonia
pickettii) 		PF13378
(MR_MLE_C) 		4 HIS A 331
PRO A 330
ASP A 329
SER A 354
 None
 0.99A 4l7iB-3p0wA:
undetectable		 4l7iB-3p0wA:
21.65
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.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  17
PRO A  18
ASP A 179
LYS A 181
ASP A 259
 None
None
None
None
CA  A 404 (-3.4A)
 0.70A 4l7iB-3rv2A:
26.4		 4l7iB-3rv2A:
25.41
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.
3rv6 ISOCHORISMATE
SYNTHASE/ISOCHORISMA
TE-PYRUVATE LYASE
MBTI

(Mycobacterium
tuberculosis) 		PF00425
(Chorismate_bind) 		4 ASP A 399
ALA A 401
TYR A  48
ASP A  51
 None
 0.97A 4l7iB-3rv6A:
undetectable		 4l7iB-3rv6A:
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.
3so4 METHIONINE-ADENOSYLT
RANSFERASE

(Entamoeba
histolytica) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  16
PRO A  17
ASP A 166
LYS A 168
ASP A 245
 None
None
None
ACT  A 400 ( 4.9A)
None
 0.62A 4l7iB-3so4A:
26.9		 4l7iB-3so4A:
25.42
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.
3tgw V-TYPE ATP SYNTHASE
BETA CHAIN

(Methanosarcina
mazei) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		4 ASP A 105
TYR A 233
SER A  81
ASP A  83
 None
 1.00A 4l7iB-3tgwA:
undetectable		 4l7iB-3tgwA:
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.
3tzg HYPOTHETICAL PROTEIN
BVU_2266

(Bacteroides
vulgatus) 		no annotation 4 ASP A 203
TYR A 120
SER A 204
ASP A 200
 None
 1.02A 4l7iB-3tzgA:
undetectable		 4l7iB-3tzgA:
22.89
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.
3u4a JMB19063

(compost
metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 HIS A  87
PRO A  96
ALA A 115
TYR A 165
 None
 0.92A 4l7iB-3u4aA:
undetectable		 4l7iB-3u4aA:
20.31
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.
3wxb UNCHARACTERIZED
PROTEIN

(Gallus gallus) 		PF00106
(adh_short) 		4 HIS A 207
PRO A 208
ALA A 161
TYR A 178
 NDP  A 300 ( 4.7A)
NDP  A 300 (-4.2A)
EDO  A 301 ( 3.8A)
EDO  A 301 ( 4.3A)
 0.95A 4l7iB-3wxbA:
undetectable		 4l7iB-3wxbA:
21.26
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.
3zlc ER-DERIVED VESICLES
PROTEIN ERV41

(Saccharomyces
cerevisiae) 		PF07970
(COPIIcoated_ERV)
PF13850
(ERGIC_N) 		4 PRO A 242
ALA A 250
SER A 289
ASP A  58
 None
 1.07A 4l7iB-3zlcA:
undetectable		 4l7iB-3zlcA:
20.64
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.
4a69 HISTONE DEACETYLASE
3,

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		4 HIS A  56
ASP A  57
TYR A  51
SER A  54
 None
None
GOL  A 505 ( 3.8A)
None
 1.05A 4l7iB-4a69A:
undetectable		 4l7iB-4a69A:
20.56
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.
4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Lactobacillus
acidophilus) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PRO A  56
ASP A  63
ALA A 163
SER A 104
 None
 1.00A 4l7iB-4aieA:
undetectable		 4l7iB-4aieA:
23.75
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.
4b29 DIMETHYLSULFONIOPROP
IONATE LYASE

(Roseovarius
nubinhibens) 		PF16867
(DMSP_lyase) 		4 HIS A  74
PRO A  73
LYS A   2
ALA A   5
 None
None
PO4  A1199 (-3.3A)
None
 0.95A 4l7iB-4b29A:
undetectable		 4l7iB-4b29A:
19.80
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.
4b4o EPIMERASE FAMILY
PROTEIN SDR39U1

(Homo sapiens) 		PF01370
(Epimerase)
PF08338
(DUF1731) 		4 HIS A 194
ASP A 197
ALA A 199
SER A 280
 None
 1.01A 4l7iB-4b4oA:
undetectable		 4l7iB-4b4oA:
22.41
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.
4cja BURRH

(Paraburkholderia
rhizoxinica) 		PF03377
(TAL_effector) 		4 PRO A 514
ASP A 515
ALA A 547
SER A 512
 None
 1.01A 4l7iB-4cjaA:
undetectable		 4l7iB-4cjaA:
19.62
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.
4dgq NON-HEME
CHLOROPEROXIDASE

(Burkholderia
cenocepacia) 		PF00561
(Abhydrolase_1) 		4 ASP A  56
LYS A  15
ALA A  54
SER A  34
 None
 1.06A 4l7iB-4dgqA:
undetectable		 4l7iB-4dgqA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4evq PUTATIVE ABC
TRANSPORTER SUBUNIT,
SUBSTRATE-BINDING
COMPONENT

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		4 PRO A  41
ASP A  80
ALA A 112
SER A  82
 None
None
None
ACT  A 405 (-4.5A)
 0.93A 4l7iB-4evqA:
undetectable		 4l7iB-4evqA:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g8t GLUCARATE
DEHYDRATASE

(Actinobacillus
succinogenes) 		PF13378
(MR_MLE_C) 		4 HIS A 311
PRO A 310
ASP A 309
SER A 334
 None
 0.98A 4l7iB-4g8tA:
undetectable		 4l7iB-4g8tA:
22.14
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.
4hoz SUCROSE ISOMERASE

(Erwinia
rhapontici) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PRO A  99
ASP A 106
ALA A 206
SER A 147
 None
 0.96A 4l7iB-4hozA:
undetectable		 4l7iB-4hozA:
23.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4hpv S-ADENOSYLMETHIONINE
SYNTHASE

(Sulfolobus
solfataricus) 		PF01941
(AdoMet_Synthase) 		7 HIS A  29
PRO A  30
ASP A 199
LYS A 201
ALA A 216
TYR A 270
SER A 277
 None
 0.22A 4l7iB-4hpvA:
61.9		 4l7iB-4hpvA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4hpv S-ADENOSYLMETHIONINE
SYNTHASE

(Sulfolobus
solfataricus) 		PF01941
(AdoMet_Synthase) 		7 PRO A  30
ASP A 199
LYS A 201
ALA A 216
TYR A 270
SER A 277
ASP A 282
 None
 0.83A 4l7iB-4hpvA:
61.9		 4l7iB-4hpvA:
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.
4hyr GLUCARATE
DEHYDRATASE

(Acidaminococcus
intestini) 		PF13378
(MR_MLE_C) 		4 HIS A 311
PRO A 310
ASP A 309
SER A 334
 None
 0.96A 4l7iB-4hyrA:
undetectable		 4l7iB-4hyrA:
23.55
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.
4j35 PHOSPHOTRIESTERASE,
PUTATIVE

(Deinococcus
radiodurans) 		PF02126
(PTE) 		4 HIS A 204
ASP A 206
ALA A 225
ASP A 264
 CO  A 401 (-3.2A)
None
None
CO  A 402 (-2.7A)
 1.06A 4l7iB-4j35A:
undetectable		 4l7iB-4j35A:
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.
4k2h INTRACELLULAR
PROTEASE/AMIDASE

(Salmonella
enterica) 		PF01965
(DJ-1_PfpI) 		4 HIS A 155
PRO A 140
ASP A 158
TYR A 183
 None
 1.03A 4l7iB-4k2hA:
undetectable		 4l7iB-4k2hA:
19.11
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.
4k35 GLYCOSIDE HYDROLASE
FAMILY 81
ENDO-BETA-1,3-GLUCAN
ASE

(Rhizomucor
miehei) 		PF03639
(Glyco_hydro_81) 		4 PRO A 296
ALA A 162
TYR A 163
SER A 262
 None
 1.05A 4l7iB-4k35A:
undetectable		 4l7iB-4k35A:
20.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l4q S-ADENOSYLMETHIONINE
SYNTHASE

(Thermococcus
kodakarensis) 		PF01941
(AdoMet_Synthase) 		7 HIS A  33
PRO A  34
ASP A 201
ALA A 218
TYR A 271
SER A 278
ASP A 283
 None
 0.82A 4l7iB-4l4qA:
55.6		 4l7iB-4l4qA:
51.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l4q S-ADENOSYLMETHIONINE
SYNTHASE

(Thermococcus
kodakarensis) 		PF01941
(AdoMet_Synthase) 		7 HIS A  33
PRO A  34
ASP A 201
LYS A 203
ALA A 218
TYR A 271
SER A 278
 None
 0.48A 4l7iB-4l4qA:
55.6		 4l7iB-4l4qA:
51.33
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.
4le5 S-ADENOSYLMETHIONINE
SYNTHETASE

(Campylobacter
jejuni) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  13
PRO A  14
ASP A 168
LYS A 170
ASP A 250
 None
 0.63A 4l7iB-4le5A:
25.7		 4l7iB-4le5A:
25.16
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.
4o6z SERINE
HYDROXYMETHYLTRANSFE
RASE

(Plasmodium
falciparum) 		PF00464
(SHMT) 		4 HIS A 129
ASP A 208
ALA A 104
SER A 210
 PLP  A 701 (-3.6A)
PLP  A 701 (-2.7A)
None
PLP  A 701 (-3.4A)
 1.01A 4l7iB-4o6zA:
undetectable		 4l7iB-4o6zA:
22.82
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.
4odj S-ADENOSYLMETHIONINE
SYNTHASE

(Cryptosporidium
hominis) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  34
PRO A  35
ASP A 187
LYS A 189
ASP A 266
 SAM  A 500 ( 3.8A)
SAM  A 500 (-4.3A)
SAM  A 500 (-2.8A)
3PO  A 501 ( 2.7A)
SAM  A 500 (-3.3A)
 0.33A 4l7iB-4odjA:
26.3		 4l7iB-4odjA:
25.11
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.
4oqj PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 HIS A 240
ALA A  75
TYR A 227
SER A 236
 None
 1.01A 4l7iB-4oqjA:
undetectable		 4l7iB-4oqjA:
18.36
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.
4p3w FILAMIN-A

(Homo sapiens) 		PF00630
(Filamin) 		4 HIS A2315
PRO A2320
LYS A2310
ALA A2272
 None
 1.03A 4l7iB-4p3wA:
undetectable		 4l7iB-4p3wA:
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.
4r9g MBP1

(Caldanaerobius
polysaccharolyticus) 		PF13416
(SBP_bac_8) 		4 HIS A 195
ASP A  89
ALA A  60
TYR A  85
 ZN  A 505 ( 3.1A)
ZN  A 505 (-3.0A)
MAN  A 501 ( 4.7A)
None
 0.87A 4l7iB-4r9gA:
undetectable		 4l7iB-4r9gA:
22.25
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.
4ru4 TAIL SPIKE PROTEIN
GP49

(Pseudomonas
virus LKA1) 		PF13229
(Beta_helix) 		4 HIS A 238
ALA A 376
SER A 265
ASP A 261
 None
 1.01A 4l7iB-4ru4A:
undetectable		 4l7iB-4ru4A:
22.35
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.
4ug4 CHOLINE SULFATASE

(Sinorhizobium
meliloti) 		PF00884
(Sulfatase)
PF12411
(Choline_sulf_C) 		4 HIS A 297
LYS A 309
TYR A 262
ASP A  14
 MN  A1513 (-3.5A)
None
None
MN  A1513 (-2.4A)
 0.89A 4l7iB-4ug4A:
undetectable		 4l7iB-4ug4A:
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.
4uph SULFATASE (SULFURIC
ESTER HYDROLASE)
PROTEIN

(Agrobacterium
tumefaciens) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		4 HIS A 329
LYS A 341
TYR A 294
ASP A  24
 MG  A1001 (-3.1A)
DDZ  A  64 ( 4.6A)
None
MG  A1001 (-1.9A)
 1.08A 4l7iB-4uphA:
undetectable		 4l7iB-4uphA:
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.
4upl SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		4 HIS A 327
LYS A 339
TYR A 292
ASP A   9
 ZN  A1553 (-3.2A)
None
None
ZN  A1553 (-2.2A)
 0.94A 4l7iB-4uplA:
undetectable		 4l7iB-4uplA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zi5 P91

(metagenome) 		PF01738
(DLH) 		4 HIS A 209
ALA A  38
SER A 200
ASP A 203
 None
 0.97A 4l7iB-4zi5A:
undetectable		 4l7iB-4zi5A:
20.05
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.
5a1i S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2

(Homo sapiens) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 HIS A  29
PRO A  30
ASP A 179
LYS A 181
ASP A 258
 SAM  A 405 ( 3.6A)
SAM  A 405 (-4.0A)
ADN  A 407 (-2.8A)
PPK  A 400 ( 2.6A)
K  A 403 ( 3.0A)
 0.33A 4l7iB-5a1iA:
26.4		 4l7iB-5a1iA:
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.
5bvl DESIGNED TIM BARREL
STIM11

(synthetic
construct) 		no annotation 5 ASP A 167
ALA A 143
TYR A 160
SER A 162
ASP A 163
 None
 1.49A 4l7iB-5bvlA:
undetectable		 4l7iB-5bvlA:
18.56
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.
5cef ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 PRO A 130
ALA A 166
TYR A 281
ASP A 284
 None
 1.01A 4l7iB-5cefA:
undetectable		 4l7iB-5cefA:
23.23
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.
5e5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Mus musculus) 		PF00194
(Carb_anhydrase) 		4 HIS A 279
ALA A 283
SER A 277
ASP A 210
 None
 1.02A 4l7iB-5e5uA:
undetectable		 4l7iB-5e5uA:
20.87
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.
5eeb ALDEHYDE
DEHYDROGENASE

(Pyrobaculum
ferrireducens) 		PF00171
(Aldedh) 		4 PRO A  20
ASP A  47
ALA A  51
SER A  43
 None
 1.06A 4l7iB-5eebA:
undetectable		 4l7iB-5eebA:
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.
5fic SPHINGOMYELIN
PHOSPHODIESTERASE

(Mus musculus) 		PF00149
(Metallophos) 		4 ASP A 499
ALA A 194
TYR A 502
SER A 506
 None
 1.07A 4l7iB-5ficA:
undetectable		 4l7iB-5ficA:
21.52
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.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		4 HIS A 335
LYS A 347
ALA A 346
ASP A  45
 CA  A1551 (-3.3A)
ALS  A  84 ( 2.6A)
None
CA  A1551 (-3.0A)
 1.04A 4l7iB-5fqlA:
undetectable		 4l7iB-5fqlA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		4 HIS A 335
LYS A 347
TYR A 300
ASP A  45
 CA  A1551 (-3.3A)
ALS  A  84 ( 2.6A)
None
CA  A1551 (-3.0A)
 0.88A 4l7iB-5fqlA:
undetectable		 4l7iB-5fqlA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fse UREASE SUBUNIT ALPHA

(Sporosarcina
pasteurii) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		4 HIS C 275
ALA C 247
SER C 361
ASP C 363
 NI  C 600 ( 3.3A)
KCX  C 220 ( 4.0A)
None
NI  C 601 ( 2.6A)
 1.07A 4l7iB-5fseC:
undetectable		 4l7iB-5fseC:
24.02
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.
5gnx BETA-GLUCOSIDASE

(metagenome) 		PF00232
(Glyco_hydro_1) 		4 ASP A  41
ALA A  35
SER A  38
ASP A 128
 None
 1.06A 4l7iB-5gnxA:
undetectable		 4l7iB-5gnxA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h2t TREHALOSE SYNTHASE

(Thermomonospora
curvata) 		no annotation 4 HIS A 184
ASP A 123
SER A 122
ASP A  81
 None
 1.01A 4l7iB-5h2tA:
undetectable		 4l7iB-5h2tA:
19.24
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.
5h8w ATP-DEPENDENT DNA
HELICASE TA0057

(Thermoplasma
acidophilum) 		PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2) 		4 HIS A 253
ASP A 245
SER A 255
ASP A 256
 None
None
NA  A 803 ( 4.8A)
None
 1.05A 4l7iB-5h8wA:
undetectable		 4l7iB-5h8wA:
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.
5h9u S-ADENOSYLMETHIONINE
SYNTHASE

(Thermus
thermophilus) 		no annotation 4 HIS C  16
PRO C  17
ASP C 175
ASP C 251
 None
 0.78A 4l7iB-5h9uC:
27.1		 4l7iB-5h9uC:
24.12
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.
5h9u S-ADENOSYLMETHIONINE
SYNTHASE

(Thermus
thermophilus) 		no annotation 4 HIS C  16
PRO C  17
LYS C 177
ASP C 251
 None
 1.07A 4l7iB-5h9uC:
27.1		 4l7iB-5h9uC:
24.12
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.
5ivl DEAD-BOX
ATP-DEPENDENT RNA
HELICASE CSHA

(Geobacillus
stearothermophilus) 		no annotation 4 ASP B 320
ALA B  77
SER B 323
ASP B 298
 None
 1.06A 4l7iB-5ivlB:
undetectable		 4l7iB-5ivlB:
23.38
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.
5jhe PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYP7

(Saccharomyces
cerevisiae) 		PF00160
(Pro_isomerase)
PF00515
(TPR_1) 		4 HIS A 227
ASP A 225
ALA A 239
TYR A 269
 None
 1.02A 4l7iB-5jheA:
undetectable		 4l7iB-5jheA:
22.57
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.
5jn9 CARBONIC ANHYDRASE 4

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		4 PRO A 137
ASP A 139
ALA A  86
TYR A  88
 None
 1.07A 4l7iB-5jn9A:
undetectable		 4l7iB-5jn9A:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nfn JMJC
DOMAIN-CONTAINING
PROTEIN 7

(Homo sapiens) 		no annotation 4 HIS A 278
ALA A 258
TYR A 253
ASP A 241
 None
 0.92A 4l7iB-5nfnA:
undetectable		 4l7iB-5nfnA:
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.
5t8t S-ADENOSYLMETHIONINE
SYNTHASE

(Neisseria
gonorrhoeae) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 HIS A  15
PRO A  16
ASP A 166
ASP A 243
 None
 0.60A 4l7iB-5t8tA:
26.7		 4l7iB-5t8tA:
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 HIS A 115
PRO A 124
ALA A 143
TYR A 193
 None
 0.95A 4l7iB-5tf0A:
undetectable		 4l7iB-5tf0A:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u1s SEPARIN

(Saccharomyces
cerevisiae) 		PF03568
(Peptidase_C50) 		4 HIS A1112
ASP A1108
ALA A1155
SER A1421
 None
 0.96A 4l7iB-5u1sA:
undetectable		 4l7iB-5u1sA:
13.88
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.
5us8 ARGININOSUCCINATE
SYNTHASE

(Bordetella
pertussis) 		PF00764
(Arginosuc_synth) 		4 ASP A 128
ALA A  17
SER A 130
ASP A 136
 None
 0.95A 4l7iB-5us8A:
undetectable		 4l7iB-5us8A:
24.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xeq MAM
DOMAIN-CONTAINING
GLYCOSYLPHOSPHATIDYL
INOSITOL ANCHOR
PROTEIN 1

(Homo sapiens) 		PF13927
(Ig_3) 		4 ASP B 208
ALA B 210
TYR B 212
ASP B 181
 None
 1.03A 4l7iB-5xeqB:
undetectable		 4l7iB-5xeqB:
23.76
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.
5xmr SERINE
HYDROXYMETHYLTRANSFE
RASE

(Plasmodium
vivax) 		no annotation 4 HIS A 129
ASP A 208
ALA A 104
SER A 210
 PLG  A 501 ( 3.5A)
PLG  A 501 (-3.1A)
None
PLG  A 501 (-3.5A)
 1.01A 4l7iB-5xmrA:
undetectable		 4l7iB-5xmrA:
25.76
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 HIS A 113
PRO A 122
ALA A 141
TYR A 191
 None
 0.89A 4l7iB-5xxoA:
undetectable		 4l7iB-5xxoA:
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.
6c26 DOLICHYL-DIPHOSPHOOL
IGOSACCHARIDE--PROTE
IN
GLYCOSYLTRANSFERASE
SUBUNIT STT3

(Saccharomyces
cerevisiae) 		no annotation 4 HIS A 266
PRO A 260
ALA A 269
TYR A 243
 None
 0.88A 4l7iB-6c26A:
undetectable		 4l7iB-6c26A:
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.
6cr0 (S)-6-HYDROXYNICOTIN
E OXIDASE

(Shinella sp.
HZN7) 		no annotation 4 HIS A  67
PRO A  66
ASP A 416
ALA A 408
 None
 1.06A 4l7iB-6cr0A:
undetectable		 4l7iB-6cr0A:
22.27