SIMILAR PATTERNS OF AMINO ACIDS FOR 5AYF_A_C7HA402_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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		4 GLY A 137
TYR A  39
TYR A 154
GLY A 152
 None
 0.98A 5ayfA-1bf2A:
0.0		 5ayfA-1bf2A:
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.
1c0i D-AMINO ACID OXIDASE

(Rhodotorula
toruloides) 		PF01266
(DAO) 		4 TYR A1132
GLY A1129
TYR A1108
GLY A1105
 None
 1.06A 5ayfA-1c0iA:
0.0		 5ayfA-1c0iA:
20.60
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.
1e3d [NIFE] HYDROGENASE
LARGE SUBUNIT
[NIFE] HYDROGENASE
SMALL SUBUNIT

(Desulfovibrio
desulfuricans) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 TYR B 336
GLY B  50
TYR A  86
GLY A  87
 None
 0.94A 5ayfA-1e3dB:
0.0		 5ayfA-1e3dB:
17.52
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT
METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		4 TYR B 368
GLY A 332
TYR A 336
GLY A 486
 TP7  A1554 (-4.1A)
None
None
None
 1.05A 5ayfA-1e6vB:
undetectable		 5ayfA-1e6vB:
20.22
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		4 TYR B2365
GLY A1342
TYR A1346
GLY A1503
 TP7  A2571 (-3.9A)
None
None
None
 1.06A 5ayfA-1e6yB:
undetectable		 5ayfA-1e6yB:
19.95
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.
1e8b FIBRONECTIN

(Homo sapiens) 		PF00039
(fn1)
PF00040
(fn2) 		4 TYR A 122
GLY A 134
TYR A 148
GLY A 109
 None
 0.85A 5ayfA-1e8bA:
0.0		 5ayfA-1e8bA:
19.55
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.
1g6q HNRNP ARGININE
N-METHYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF06325
(PrmA) 		4 TYR 1 345
GLY 1 253
TYR 1 325
GLY 1 305
 None
 0.91A 5ayfA-1g6q1:
undetectable		 5ayfA-1g6q1:
18.50
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT ALPHA

(Desulfovibrio
gigas) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 TYR A 262
GLY A 402
TYR A 170
GLY A 171
 None
 1.03A 5ayfA-1h0hA:
undetectable		 5ayfA-1h0hA:
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.
1k72 ENDOGLUCANASE 9G

([Clostridium]
cellulolyticum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 TYR A 198
GLY A 203
TYR A 116
GLY A 119
 GOL  A 783 (-4.6A)
None
None
None
 1.07A 5ayfA-1k72A:
undetectable		 5ayfA-1k72A:
17.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mt6 SET9

(Homo sapiens) 		PF00856
(SET)
PF02493
(MORN) 		5 TYR A 245
GLY A 264
TYR A 305
TYR A 335
GLY A 336
 None
SAH  A   1 ( 4.1A)
None
SAH  A   1 (-4.4A)
None
 0.94A 5ayfA-1mt6A:
32.7		 5ayfA-1mt6A:
77.36
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.
1n61 CARBON MONOXIDE
DEHYDROGENASE MEDIUM
CHAIN

(Oligotropha
carboxidovorans) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		4 TYR C 152
GLY C 114
TYR C 153
GLY C 122
 None
FAD  C3932 (-3.4A)
None
None
 1.02A 5ayfA-1n61C:
undetectable		 5ayfA-1n61C:
19.87
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.
1up4 6-PHOSPHO-BETA-GLUCO
SIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 GLY A  67
TYR A 123
TYR A  35
GLY A   7
 None
 1.03A 5ayfA-1up4A:
undetectable		 5ayfA-1up4A:
19.76
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.
1vb3 THREONINE SYNTHASE

(Escherichia
coli) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		4 TYR A 226
GLY A 251
TYR A 225
GLY A 110
 None
SO4  A 501 (-3.6A)
None
None
 1.07A 5ayfA-1vb3A:
undetectable		 5ayfA-1vb3A:
18.72
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.
1whs SERINE
CARBOXYPEPTIDASE II

(Triticum
aestivum) 		PF00450
(Peptidase_S10) 		4 TYR A 239
GLY A  53
TYR A  60
GLY A  61
 None
ACY  A 460 ( 4.3A)
ACY  A 460 ( 4.5A)
None
 0.62A 5ayfA-1whsA:
undetectable		 5ayfA-1whsA:
21.14
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.
1x4b HETEROGENEOUS
NUCLEAR
RIBONUCLEOPROTEINS
A2/B1

(Homo sapiens) 		PF00076
(RRM_1) 		4 TYR A  48
GLY A  33
TYR A  47
GLY A  95
 None
 0.93A 5ayfA-1x4bA:
undetectable		 5ayfA-1x4bA:
21.11
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.
1z26 ARGONAUTE

(Pyrococcus
furiosus) 		PF02171
(Piwi)
PF12212
(PAZ_siRNAbind) 		4 GLY A 539
TYR A 543
TYR A 728
GLY A 729
 None
 1.01A 5ayfA-1z26A:
undetectable		 5ayfA-1z26A:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avu FLAGELLAR
TRANSCRIPTIONAL
ACTIVATOR FLHC

(Escherichia
coli) 		PF05280
(FlhC) 		4 TYR E 102
GLY E 112
TYR E  99
GLY E  23
 None
 0.93A 5ayfA-2avuE:
undetectable		 5ayfA-2avuE:
19.55
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.
2nya PERIPLASMIC NITRATE
REDUCTASE

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 TYR A 641
GLY A 601
TYR A 651
GLY A 156
 None
 1.03A 5ayfA-2nyaA:
undetectable		 5ayfA-2nyaA:
15.47
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.
2oqk PUTATIVE TRANSLATION
INITIATION FACTOR
EIF-1A

(Cryptosporidium
parvum) 		PF01176
(eIF-1a) 		4 GLY A 107
TYR A  95
TYR A  35
GLY A  36
 None
 0.83A 5ayfA-2oqkA:
undetectable		 5ayfA-2oqkA:
19.16
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.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		4 TYR A  37
GLY A 167
TYR A  42
GLY A 317
 None
 1.06A 5ayfA-2pbgA:
undetectable		 5ayfA-2pbgA:
19.65
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.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		4 TYR A  37
GLY A 172
TYR A  42
GLY A 317
 None
 1.03A 5ayfA-2pbgA:
undetectable		 5ayfA-2pbgA:
19.65
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.
2ps3 HIGH-AFFINITY ZINC
UPTAKE SYSTEM
PROTEIN ZNUA

(Escherichia
coli) 		PF01297
(ZnuA) 		4 TYR A 303
GLY A 211
TYR A 203
GLY A 223
 None
 1.00A 5ayfA-2ps3A:
undetectable		 5ayfA-2ps3A:
20.46
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.
2qm0 BES

(Bacillus cereus) 		PF00756
(Esterase) 		4 TYR A  29
GLY A 124
TYR A  86
GLY A  94
 None
 0.97A 5ayfA-2qm0A:
undetectable		 5ayfA-2qm0A:
21.61
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.
2qzu PUTATIVE SULFATASE
YIDJ

(Bacteroides
fragilis) 		PF00884
(Sulfatase) 		4 TYR A 235
GLY A 325
TYR A 271
GLY A 269
 None
 1.04A 5ayfA-2qzuA:
undetectable		 5ayfA-2qzuA:
16.87
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.
2rfz CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Melanocarpus
albomyces) 		PF00840
(Glyco_hydro_7) 		4 GLY A 204
TYR A 370
TYR A 247
GLY A 245
 None
 1.06A 5ayfA-2rfzA:
0.0		 5ayfA-2rfzA:
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.
2vpt LIPOLYTIC ENZYME

(Ruminiclostridium
thermocellum) 		PF13472
(Lipase_GDSL_2) 		4 TYR A 158
GLY A  42
TYR A 168
GLY A 136
 None
 0.99A 5ayfA-2vptA:
undetectable		 5ayfA-2vptA:
21.74
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.
2xfg ENDOGLUCANASE 1

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9) 		4 TYR A 199
GLY A 204
TYR A 117
GLY A 120
 None
 1.06A 5ayfA-2xfgA:
undetectable		 5ayfA-2xfgA:
17.95
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.
2y35 LD22664P

(Drosophila
melanogaster) 		PF03159
(XRN_N) 		4 TYR A 449
GLY A 176
TYR A 450
GLY A 212
 None
 0.78A 5ayfA-2y35A:
undetectable		 5ayfA-2y35A:
12.20
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.
2y3s TAML

(Streptomyces
sp. 307-9) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 TYR A 447
GLY A 120
TYR A  64
GLY A  61
 TIR  A 700 (-4.0A)
FAD  A 600 (-3.3A)
FAD  A 600 ( 4.6A)
FAD  A 600 (-3.3A)
 1.02A 5ayfA-2y3sA:
undetectable		 5ayfA-2y3sA:
17.67
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.
2zsj THREONINE SYNTHASE

(Aquifex
aeolicus) 		PF00291
(PALP) 		4 GLY A 208
TYR A  14
TYR A 204
GLY A 200
 None
 1.00A 5ayfA-2zsjA:
undetectable		 5ayfA-2zsjA:
18.70
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.
2zy2 L-ASPARTATE
4-CARBOXYLYASE

(Pseudomonas sp.
ATCC 19121) 		PF00155
(Aminotran_1_2) 		4 TYR A 151
GLY A 290
TYR A 316
GLY A 318
 None
 1.01A 5ayfA-2zy2A:
undetectable		 5ayfA-2zy2A:
19.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3cbo HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7

(Homo sapiens) 		PF00856
(SET) 		5 TYR A 245
GLY A 264
TYR A 305
TYR A 335
GLY A 336
 None
SAH  A   1 (-4.0A)
None
SAH  A   1 (-4.9A)
None
 0.42A 5ayfA-3cboA:
38.2		 5ayfA-3cboA:
94.92
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.
3dhu ALPHA-AMYLASE

(Lactobacillus
plantarum) 		PF00128
(Alpha-amylase) 		4 GLY A 303
TYR A 224
TYR A 267
GLY A 265
 None
 0.98A 5ayfA-3dhuA:
undetectable		 5ayfA-3dhuA:
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.
3gec PERIOD CIRCADIAN
PROTEIN

(Drosophila
melanogaster) 		PF00989
(PAS)
PF14598
(PAS_11) 		4 TYR A 459
GLY A 491
TYR A 428
GLY A 399
 None
 1.03A 5ayfA-3gecA:
undetectable		 5ayfA-3gecA:
21.36
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.
3gm8 GLYCOSIDE HYDROLASE
FAMILY 2, CANDIDATE
BETA-GLYCOSIDASE

(Bacteroides
vulgatus) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 TYR A 161
GLY A  63
TYR A 771
GLY A 759
 None
 0.99A 5ayfA-3gm8A:
undetectable		 5ayfA-3gm8A:
14.89
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.
3gyr PHENOXAZINONE
SYNTHASE

(Streptomyces
antibioticus) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 TYR A 402
GLY A  39
TYR A 286
GLY A 258
 None
 0.86A 5ayfA-3gyrA:
undetectable		 5ayfA-3gyrA:
17.26
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.
3hdy UDP-GALACTOPYRANOSE
MUTASE

(Deinococcus
radiodurans) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		4 GLY A  65
TYR A 334
TYR A  82
GLY A  83
 None
FAD  A 450 ( 4.8A)
None
FAD  A 450 ( 4.1A)
 0.87A 5ayfA-3hdyA:
undetectable		 5ayfA-3hdyA:
19.85
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.
3hlm ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Mus musculus) 		PF00155
(Aminotran_1_2) 		4 TYR A 246
GLY A  65
TYR A 284
GLY A 285
 LLP  A 279 ( 4.4A)
GOL  A   1 ( 4.6A)
LLP  A 279 ( 4.6A)
None
 0.92A 5ayfA-3hlmA:
undetectable		 5ayfA-3hlmA:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iwg ACETYLTRANSFERASE,
GNAT FAMILY

(Colwellia
psychrerythraea) 		PF00583
(Acetyltransf_1) 		4 TYR A 169
GLY A 208
TYR A 170
GLY A 181
 None
 1.04A 5ayfA-3iwgA:
undetectable		 5ayfA-3iwgA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jd5 28S RIBOSOMAL
PROTEIN S5,
MITOCHONDRIAL

(Bos taurus) 		PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C) 		4 TYR E 333
GLY E 424
TYR E 312
GLY E 311
 None
 0.88A 5ayfA-3jd5E:
undetectable		 5ayfA-3jd5E:
19.08
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.
3k7y ASPARTATE
AMINOTRANSFERASE

(Plasmodium
falciparum) 		PF00155
(Aminotran_1_2) 		4 TYR A 216
GLY A  37
TYR A 254
GLY A 255
 PLP  A 406 (-4.5A)
None
None
None
 1.04A 5ayfA-3k7yA:
undetectable		 5ayfA-3k7yA:
20.24
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.
3mst PUTATIVE NITRATE
TRANSPORT PROTEIN

(Thermoplasma
volcanium) 		PF12916
(DUF3834) 		4 TYR A  62
GLY A   9
TYR A 193
GLY A 194
 ACT  A 232 ( 4.6A)
ACT  A 232 ( 4.8A)
None
None
 1.00A 5ayfA-3mstA:
undetectable		 5ayfA-3mstA:
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria sp.
TM1040) 		PF03070
(TENA_THI-4) 		4 TYR A 172
GLY A 143
TYR A   5
GLY A 180
 EDO  A 237 (-4.7A)
None
None
None
 1.00A 5ayfA-3mvuA:
undetectable		 5ayfA-3mvuA:
19.70
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.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)

(Kluyveromyces
lactis) 		PF03159
(XRN_N) 		4 TYR A 547
GLY A 177
TYR A 548
GLY A 213
 None
 0.90A 5ayfA-3pieA:
undetectable		 5ayfA-3pieA:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pxx CARVEOL
DEHYDROGENASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 TYR A  47
GLY A 104
TYR A 174
GLY A 173
 None
NAD  A 284 (-3.7A)
NAD  A 284 (-4.5A)
None
 0.78A 5ayfA-3pxxA:
undetectable		 5ayfA-3pxxA:
22.40
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.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA) 		PF09251
(PhageP22-tail) 		4 TYR A 371
GLY A 231
TYR A 344
TYR A 225
 None
 0.79A 5ayfA-3riqA:
undetectable		 5ayfA-3riqA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rty PERIOD CIRCADIAN
PROTEIN

(Drosophila
melanogaster) 		PF00989
(PAS)
PF14598
(PAS_11) 		4 TYR A 459
GLY A 491
TYR A 428
GLY A 399
 None
 0.98A 5ayfA-3rtyA:
undetectable		 5ayfA-3rtyA:
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.
3sqg METHYL COENZYME M
REDUCTASE, ALPHA
SUBUNIT
METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(uncultured
archaeon) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		4 TYR B 363
GLY A 343
TYR A 347
GLY A 502
 TP7  A1002 (-4.1A)
None
None
None
 1.05A 5ayfA-3sqgB:
undetectable		 5ayfA-3sqgB:
19.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sx2 PUTATIVE
3-KETOACYL-(ACYL-CAR
RIER-PROTEIN)
REDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 TYR A  52
GLY A 109
TYR A 173
GLY A 172
 None
NAD  A 300 (-3.5A)
NAD  A 300 (-4.6A)
None
 0.84A 5ayfA-3sx2A:
undetectable		 5ayfA-3sx2A:
21.00
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.
3tpu 42F3 ALPHA
42F3 BETA

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		4 TYR B  50
GLY A  96
TYR B  31
GLY B  98
 None
 0.74A 5ayfA-3tpuB:
undetectable		 5ayfA-3tpuB:
20.36
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai) 		PF00150
(Cellulase) 		4 TYR A 197
GLY A 165
TYR A 240
GLY A 223
 None
 1.03A 5ayfA-3vupA:
undetectable		 5ayfA-3vupA:
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		4 TYR A1001
TYR A1040
TYR A1045
GLY A1046
 None
 1.03A 5ayfA-4amcA:
undetectable		 5ayfA-4amcA:
13.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bhi GAMMA-BUTYROBETAINE
DIOXYGENASE

(Homo sapiens) 		PF02668
(TauD)
PF06155
(DUF971) 		4 GLY A 263
TYR A 205
TYR A 177
GLY A 178
 None
RUJ  A 401 (-4.1A)
RUJ  A 401 (-3.8A)
None
 0.94A 5ayfA-4bhiA:
undetectable		 5ayfA-4bhiA:
17.82
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.
4c1q HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9

(Mus musculus) 		PF00856
(SET) 		4 TYR A 276
GLY A 290
TYR A 357
GLY A 358
 None
 0.58A 5ayfA-4c1qA:
10.2		 5ayfA-4c1qA:
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF01839
(FG-GAP)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF08441
(Integrin_alpha2)
PF17205
(PSI_integrin) 		4 TYR B 318
GLY B 221
TYR A 353
GLY A 354
 None
 0.69A 5ayfA-4cakB:
undetectable		 5ayfA-4cakB:
17.47
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.
4dns FAD-LINKED
OXIDOREDUCTASE BG60

(Cynodon
dactylon) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 TYR A 439
GLY A 150
TYR A  90
GLY A  87
 FAD  A 501 (-4.8A)
FAD  A 501 (-3.5A)
FAD  A 501 (-4.5A)
FAD  A 501 (-3.2A)
 0.98A 5ayfA-4dnsA:
undetectable		 5ayfA-4dnsA:
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.
4doe 1,4-BETA-GLUCANASE

(Caldicellulosiruptor
bescii) 		PF00759
(Glyco_hydro_9) 		4 TYR A 220
GLY A 225
TYR A 138
GLY A 141
 None
EDO  A 536 ( 4.8A)
None
None
 1.03A 5ayfA-4doeA:
undetectable		 5ayfA-4doeA:
19.87
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.
4e3e MAOC DOMAIN PROTEIN
DEHYDRATASE

(Chloroflexus
aurantiacus) 		PF01575
(MaoC_dehydratas) 		4 TYR A 143
GLY A  75
TYR A  91
GLY A 251
 None
 0.95A 5ayfA-4e3eA:
undetectable		 5ayfA-4e3eA:
18.77
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.
4lpq ERFK/YBIS/YCFS/YNHG
FAMILY PROTEIN

(Xylanimonas
cellulosilytica) 		PF01471
(PG_binding_1)
PF03734
(YkuD) 		4 GLY A 176
TYR A 151
TYR A 195
GLY A 194
 None
 0.96A 5ayfA-4lpqA:
undetectable		 5ayfA-4lpqA:
22.76
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.
4o9x TCDB2, TCCC3

(Photorhabdus
luminescens) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 GLY A2116
TYR A2148
TYR A2135
GLY A2137
 None
 1.07A 5ayfA-4o9xA:
undetectable		 5ayfA-4o9xA:
7.66
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 TYR A 370
GLY A 286
TYR A 366
GLY A 416
 None
 0.94A 5ayfA-4r1dA:
undetectable		 5ayfA-4r1dA:
19.01
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.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		4 TYR A2188
GLY A2659
TYR A2735
GLY A2733
 None
 1.07A 5ayfA-4tvcA:
undetectable		 5ayfA-4tvcA:
12.49
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.
4u6h HEAVY CHAIN OF
MURINE ANTI-VACCINIA
L1 IGG2A ANTIBODY
M12B9
PROTEIN L1

(Mus musculus;
Vaccinia virus) 		PF02442
(L1R_F9L)
PF07654
(C1-set)
PF07686
(V-set) 		4 GLY E 152
TYR A  50
TYR A  57
GLY A  56
 None
 0.79A 5ayfA-4u6hE:
undetectable		 5ayfA-4u6hE:
18.52
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.
4u9i PERIPLASMIC [NIFE]
HYDROGENASE LARGE
SUBUNIT
PERIPLASMIC [NIFE]
HYDROGENASE SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 TYR L 344
GLY L  60
TYR S  86
GLY S  87
 None
 1.01A 5ayfA-4u9iL:
undetectable		 5ayfA-4u9iL:
17.90
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		4 TYR A 204
GLY A  28
TYR A 242
GLY A 243
 PLP  A 500 (-4.4A)
None
None
None
 0.91A 5ayfA-4w5kA:
undetectable		 5ayfA-4w5kA:
20.65
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.
4wgk NEUTRAL CERAMIDASE

(Homo sapiens) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		4 TYR A 579
GLY A 122
TYR A 591
GLY A 465
 ZN  A 801 ( 4.3A)
PO4  A 810 (-4.4A)
PO4  A 810 (-4.4A)
None
 1.06A 5ayfA-4wgkA:
undetectable		 5ayfA-4wgkA:
16.16
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.
4yxt POLYKETIDE
BIOSYNTHESIS
3-HYDROXY-3-METHYLGL
UTARYL-ACP SYNTHASE
PKSG

(Bacillus
subtilis) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 TYR A 335
GLY A 120
TYR A 115
GLY A 327
 None
 0.88A 5ayfA-4yxtA:
undetectable		 5ayfA-4yxtA:
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.
4ztp HEAVY CHAIN OF FAB
FRAGMENT OF RABBIT
MONOCLONAL ANTIBODY
R53
LIGHT CHAIN OF FAB
FRAGMENT OF RABBIT
MONOCLONAL ANTIBODY
R53

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR L  50
GLY H  98
TYR L  32
GLY L  94
 None
 0.69A 5ayfA-4ztpL:
undetectable		 5ayfA-4ztpL:
20.22
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA
METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		4 TYR B 367
GLY A 331
TYR A 335
GLY A 485
 None
None
COM  A 601 ( 4.9A)
None
 1.02A 5ayfA-5a8rB:
undetectable		 5ayfA-5a8rB:
19.07
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.
5ao0 DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1

(Homo sapiens) 		PF01966
(HD) 		4 TYR A 331
GLY A 124
TYR A 173
GLY A 172
 None
 1.00A 5ayfA-5ao0A:
undetectable		 5ayfA-5ao0A:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 TYR A 778
GLY A 627
TYR A 774
GLY A 640
 None
 1.00A 5ayfA-5bp1A:
undetectable		 5ayfA-5bp1A:
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.
5bv9 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Bacillus
pumilus) 		PF02011
(Glyco_hydro_48) 		4 TYR A 291
GLY A 287
TYR A 265
GLY A 314
 None
 1.04A 5ayfA-5bv9A:
undetectable		 5ayfA-5bv9A:
16.76
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		4 GLY A  80
TYR A 150
TYR A  95
GLY A  93
 None
 0.94A 5ayfA-5bzaA:
undetectable		 5ayfA-5bzaA:
19.26
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.
5c5g SPHERULIN-4

(Aspergillus
clavatus) 		PF12138
(Spherulin4) 		4 TYR A 146
GLY A  95
TYR A 108
GLY A 106
 None
 0.96A 5ayfA-5c5gA:
undetectable		 5ayfA-5c5gA:
21.20
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.
5dl5 MEMBRANE PROTEIN

(Acinetobacter
baumannii) 		PF03573
(OprD) 		4 GLY A 313
TYR A 387
TYR A 397
GLY A 395
 None
 1.07A 5ayfA-5dl5A:
undetectable		 5ayfA-5dl5A:
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.
5elh RING FINGER PROTEIN
UNKEMPT HOMOLOG

(Mus musculus) 		no annotation 4 TYR A  36
GLY A 144
TYR A 120
GLY A 114
 None
 1.03A 5ayfA-5elhA:
undetectable		 5ayfA-5elhA:
15.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fp2 FERRIC ENTEROBACTIN
RECEPTOR PIRA

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 GLY A  97
TYR A 414
TYR A 142
GLY A 143
 None
 0.93A 5ayfA-5fp2A:
1.8		 5ayfA-5fp2A:
16.45
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.
5grh ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT GAMMA,
MITOCHONDRIAL

(Homo sapiens) 		PF00180
(Iso_dh) 		4 GLY B 257
TYR B 164
TYR B 260
GLY B 261
 None
 1.02A 5ayfA-5grhB:
undetectable		 5ayfA-5grhB:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h0q LIPID BINDING
PROTEIN

(Grifola
frondosa) 		no annotation 4 TYR A 198
TYR A 200
TYR A 120
GLY A 121
 None
 1.06A 5ayfA-5h0qA:
undetectable		 5ayfA-5h0qA:
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.
5ho4 HETEROGENEOUS
NUCLEAR
RIBONUCLEOPROTEINS
A2/B1

(Homo sapiens) 		PF00076
(RRM_1) 		4 TYR A  41
GLY A  26
TYR A  40
GLY A  88
 None
A  B   1 ( 3.6A)
None
None
 0.92A 5ayfA-5ho4A:
undetectable		 5ayfA-5ho4A:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hwq HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Myxococcus
xanthus) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 TYR A 349
GLY A 121
TYR A 116
GLY A 341
 None
None
None
CSO  A 115 ( 3.3A)
 1.04A 5ayfA-5hwqA:
undetectable		 5ayfA-5hwqA:
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.
5kis RHS2

(Yersinia
entomophaga) 		no annotation 4 GLY B 614
TYR B 646
TYR B 633
GLY B 635
 None
 1.06A 5ayfA-5kisB:
undetectable		 5ayfA-5kisB:
13.58
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.
5kp7 CURD

(Moorea
producens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 TYR A 335
GLY A 120
TYR A 115
GLY A 327
 None
 0.86A 5ayfA-5kp7A:
undetectable		 5ayfA-5kp7A:
21.83
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.
5l1b GLUTAMATE RECEPTOR
2,GLUTAMATE RECEPTOR
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 GLY A 212
TYR A 220
TYR A 218
GLY A 217
 None
 1.05A 5ayfA-5l1bA:
undetectable		 5ayfA-5l1bA:
15.14
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		4 TYR A 312
GLY A 398
TYR A 299
GLY A  94
 None
FAD  A 901 (-4.4A)
None
FAD  A 901 ( 4.4A)
 0.97A 5ayfA-5l46A:
undetectable		 5ayfA-5l46A:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mz9 -

(-) 		no annotation 4 TYR A 213
GLY A 403
TYR A 510
GLY A 511
 None
 1.00A 5ayfA-5mz9A:
undetectable		 5ayfA-5mz9A:
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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA
METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(Methanotorris
formicicus) 		PF02241
(MCR_beta)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
PF02783
(MCR_beta_N) 		4 TYR B 368
GLY A 331
TYR A 335
GLY A 485
 TP7  A 603 (-4.2A)
None
None
TRX  A 429 ( 4.5A)
 1.02A 5ayfA-5n28B:
undetectable		 5ayfA-5n28B:
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.
5ndx GLYCOSYL HYDROLASE

(Rhizobium
leguminosarum) 		no annotation 4 TYR A 107
GLY A  98
TYR A 154
GLY A 150
 None
 0.86A 5ayfA-5ndxA:
undetectable		 5ayfA-5ndxA:
16.19
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.
5o9c OSMOPORIN OMP36

(Klebsiella
aerogenes) 		no annotation 4 GLY C 215
TYR C 297
TYR C 218
GLY C 219
 None
 1.03A 5ayfA-5o9cC:
0.2		 5ayfA-5o9cC:
17.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5th6 MATRIX
METALLOPROTEINASE-9,
MATRIX
METALLOPROTEINASE-9

(Homo sapiens) 		PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		4 TYR A  48
GLY A 100
TYR A  54
GLY A 105
 None
 1.07A 5ayfA-5th6A:
undetectable		 5ayfA-5th6A:
21.51
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.
5u22 N2152

(Neocallimastix
frontalis) 		PF01229
(Glyco_hydro_39) 		4 TYR A 317
GLY A 284
TYR A 314
GLY A 298
 None
 0.97A 5ayfA-5u22A:
undetectable		 5ayfA-5u22A:
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.
5uao TRYPTOPHANE-5-HALOGE
NASE

(Microbispora
sp. ATCC
PTA-5024) 		PF04820
(Trp_halogenase) 		4 TYR A  77
GLY A 539
TYR A  85
GLY A  87
 None
 0.91A 5ayfA-5uaoA:
undetectable		 5ayfA-5uaoA:
18.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uiw C-C CHEMOKINE
RECEPTOR TYPE
5,RUBREDOXIN CHIMERA
C-C MOTIF CHEMOKINE
5

(Clostridium
pasteurianum;
Homo sapiens) 		PF00001
(7tm_1)
PF00048
(IL8)
PF00301
(Rubredoxin) 		4 TYR A 251
GLY B   1
TYR A 108
GLY A 111
 None
PCA  B   0 ( 2.4A)
None
None
 0.94A 5ayfA-5uiwA:
undetectable		 5ayfA-5uiwA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vgz 26S PROTEASOME
REGULATORY SUBUNIT 8

(Homo sapiens) 		no annotation 4 GLY C  70
TYR C 121
TYR C  72
GLY C  74
 None
 0.94A 5ayfA-5vgzC:
undetectable		 5ayfA-5vgzC:
16.35
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.
5wwo ESSENTIAL NUCLEAR
PROTEIN 1
PROTEIN LTV1

(Saccharomyces
cerevisiae) 		PF04180
(LTV)
PF05291
(Bystin) 		4 GLY A 320
TYR A 358
TYR C 371
GLY C 367
 None
 0.77A 5ayfA-5wwoA:
undetectable		 5ayfA-5wwoA:
22.55
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.
6brr DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 3A

(Homo sapiens) 		no annotation 4 TYR A 660
GLY A 642
TYR A 683
GLY A 685
 None
SAH  A1001 (-3.4A)
None
None
 1.02A 5ayfA-6brrA:
undetectable		 5ayfA-6brrA:
18.38
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.
6cbp DH270.6 SINGLE CHAIN
VARIABLE FRAGMENT
MAN9-V3 GLYCOPEPTIDE

(Homo sapiens;
Human
immunodeficiency
virus 1) 		no annotation 4 TYR A  33
GLY P 324
TYR A 110
GLY A 236
 None
None
NAG  P 401 (-4.0A)
None
 1.05A 5ayfA-6cbpA:
undetectable		 5ayfA-6cbpA:
13.92
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.
6f74 ALCOHOL OXIDASE

(Thermothelomyces
thermophila) 		no annotation 4 TYR A 294
GLY A 583
TYR A 556
GLY A 557
 None
GOL  A 606 (-3.9A)
None
None
 0.96A 5ayfA-6f74A:
undetectable		 5ayfA-6f74A:
15.09
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.
6fai ESSENTIAL NUCLEAR
PROTEIN 1
PROTEIN LTV1

(Saccharomyces
cerevisiae) 		no annotation 4 GLY i 320
TYR i 358
TYR j 371
GLY j 367
 None
 0.84A 5ayfA-6faii:
undetectable		 5ayfA-6faii:
15.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fm9 UDP-N-ACETYLGLUCOSAM
INE--DOLICHYL-PHOSPH
ATE
N-ACETYLGLUCOSAMINEP
HOSPHOTRANSFERASE

(Homo sapiens) 		no annotation 4 TYR A 172
GLY A 266
TYR A 169
GLY A 145
 None
 1.01A 5ayfA-6fm9A:
undetectable		 5ayfA-6fm9A:
undetectable