SIMILAR PATTERNS OF AMINO ACIDS FOR 5GS4_A_ESTA603_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.
1e0k DNA HELICASE

(Escherichia
virus T7) 		PF03796
(DnaB_C) 		5 MET A 309
THR A 311
ILE A 442
GLY A 488
LEU A 486
 None
 1.02A 5gs4A-1e0kA:
0.0		 5gs4A-1e0kA:
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.
1ek2 EPOXIDE HYDROLASE

(Mus musculus) 		PF00561
(Abhydrolase_1)
PF13419
(HAD_2) 		5 THR A 358
LEU A 356
LEU A 488
MET A 506
ILE A 510
 None
 1.15A 5gs4A-1ek2A:
undetectable		 5gs4A-1ek2A:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f0x D-LACTATE
DEHYDROGENASE

(Escherichia
coli) 		PF01565
(FAD_binding_4)
PF09330
(Lact-deh-memb) 		5 THR A 186
LEU A 187
LEU A  58
MET A 554
ILE A  72
 None
 1.02A 5gs4A-1f0xA:
undetectable		 5gs4A-1f0xA:
19.36
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.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis) 		PF00245
(Alk_phosphatase) 		5 ALA A 336
LEU A 331
MET A  39
ILE A 314
GLY A 312
 None
None
None
None
ZN  A 479 ( 4.5A)
 1.04A 5gs4A-1k7hA:
undetectable		 5gs4A-1k7hA:
21.08
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.
1l1q ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Giardia
intestinalis) 		PF00156
(Pribosyltran) 		5 MET A  99
THR A 132
LEU A 134
ALA A 135
GLU A 138
 None
SO4  A 301 (-3.7A)
None
None
None
 1.04A 5gs4A-1l1qA:
undetectable		 5gs4A-1l1qA:
22.71
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.
1n7g GDP-D-MANNOSE-4,6-DE
HYDRATASE

(Arabidopsis
thaliana) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A 354
ALA A 355
GLU A 358
ILE A 229
LEU A 298
 None
 1.09A 5gs4A-1n7gA:
undetectable		 5gs4A-1n7gA:
20.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 MET A 343
THR A 347
LEU A 349
ALA A 350
GLU A 353
MET A 388
LEU A 391
ARG A 394
MET A 421
ILE A 424
GLY A 521
LEU A 525
 EST  A   1 ( 4.0A)
None
EST  A   1 ( 4.8A)
EST  A   1 ( 3.7A)
EST  A   1 (-2.8A)
None
EST  A   1 ( 3.9A)
EST  A   1 (-3.7A)
EST  A   1 ( 4.3A)
EST  A   1 ( 4.5A)
EST  A   1 ( 4.1A)
EST  A   1 (-3.6A)
 0.36A 5gs4A-1pcgA:
37.6		 5gs4A-1pcgA:
98.77
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.
1q5q PROTEASOME
ALPHA-TYPE SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		5 MET A  13
LEU A  19
ALA A  20
GLU A 119
GLY A 108
 None
 1.04A 5gs4A-1q5qA:
undetectable		 5gs4A-1q5qA:
20.77
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.
1s5p NAD-DEPENDENT
DEACETYLASE

(Escherichia
coli) 		PF02146
(SIR2) 		5 GLU A 136
LEU A 126
ILE A 200
GLY A 196
LEU A 195
 None
 1.14A 5gs4A-1s5pA:
undetectable		 5gs4A-1s5pA:
22.43
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.
1u2c DYSTROGLYCAN

(Mus musculus) 		no annotation 5 LEU A 255
ALA A 254
MET A 284
GLY A 289
LEU A 208
 None
 1.19A 5gs4A-1u2cA:
undetectable		 5gs4A-1u2cA:
20.99
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.
1vlm SAM-DEPENDENT
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 MET A 163
ALA A 109
GLU A  82
ILE A 127
GLY A 126
 None
 1.15A 5gs4A-1vlmA:
undetectable		 5gs4A-1vlmA:
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.
1wc8 TRAFFICKING PROTEIN
PARTICLE COMPLEX
SUBUNIT3

(Mus musculus) 		PF04051
(TRAPP) 		5 ALA A  82
LEU A  60
MET A 144
GLY A 137
LEU A 135
 MYR  A1168 (-3.6A)
None
None
None
None
 0.79A 5gs4A-1wc8A:
undetectable		 5gs4A-1wc8A:
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.
1wue MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Enterococcus
faecalis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A1210
ALA A1211
ARG A1178
ILE A1135
GLY A1134
 None
 1.13A 5gs4A-1wueA:
undetectable		 5gs4A-1wueA:
21.03
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.
2aeu HYPOTHETICAL PROTEIN
MJ0158

(Methanocaldococcus
jannaschii) 		PF03841
(SelA) 		5 THR A  92
LEU A  94
ALA A  91
GLY A 216
LEU A 218
 None
 1.14A 5gs4A-2aeuA:
undetectable		 5gs4A-2aeuA:
20.37
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.
2b81 LUCIFERASE-LIKE
MONOOXYGENASE

(Bacillus cereus) 		PF00296
(Bac_luciferase) 		5 MET A  82
THR A  86
LEU A  88
ALA A  89
LEU A 119
 None
 1.14A 5gs4A-2b81A:
undetectable		 5gs4A-2b81A:
22.94
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.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY

(Porphyromonas
gingivalis) 		PF00588
(SpoU_methylase) 		5 THR A 243
ALA A 242
ILE A 209
GLY A 178
LEU A 200
 None
 1.16A 5gs4A-2i6dA:
undetectable		 5gs4A-2i6dA:
22.94
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.
2jk9 SPRY
DOMAIN-CONTAINING
SOCS BOX PROTEIN 1

(Homo sapiens) 		PF00622
(SPRY) 		5 LEU A 209
ALA A 118
LEU A 188
MET A 224
ILE A 102
 None
 1.17A 5gs4A-2jk9A:
undetectable		 5gs4A-2jk9A:
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.
2lko FERMITIN FAMILY
HOMOLOG 2

(Homo sapiens) 		PF00169
(PH) 		5 LEU A 473
ALA A 474
LEU A 375
ILE A 379
LEU A 443
 None
 1.10A 5gs4A-2lkoA:
undetectable		 5gs4A-2lkoA:
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.
2nym SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Homo sapiens) 		PF00149
(Metallophos) 		5 LEU C 158
ALA C 157
MET C 276
ILE C 259
GLY C  56
 None
 1.09A 5gs4A-2nymC:
undetectable		 5gs4A-2nymC:
22.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 MET A 343
THR A 347
LEU A 349
ALA A 350
GLU A 353
MET A 388
LEU A 391
ARG A 394
MET A 421
ILE A 424
GLY A 521
LEU A 525
 EST  A 596 (-4.8A)
None
EST  A 596 ( 4.1A)
EST  A 596 ( 3.9A)
EST  A 596 (-2.7A)
None
EST  A 596 ( 4.6A)
EST  A 596 (-4.0A)
EST  A 596 (-4.5A)
EST  A 596 ( 4.7A)
EST  A 596 ( 4.0A)
EST  A 596 (-3.6A)
 0.63A 5gs4A-2ocfA:
35.5		 5gs4A-2ocfA:
99.59
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.
2otb GFP-LIKE FLUORESCENT
CHROMOPROTEIN CFP484

(Clavularia sp.) 		PF01353
(GFP) 		5 GLU A 215
ARG A  70
MET A  18
GLY A  31
LEU A  46
 PIA  A  66 ( 3.5A)
PIA  A  66 ( 4.1A)
None
None
None
 1.14A 5gs4A-2otbA:
undetectable		 5gs4A-2otbA:
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.
2p3e DIAMINOPIMELATE
DECARBOXYLASE

(Aquifex
aeolicus) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 LEU A 278
LEU A  59
ILE A  99
GLY A  77
LEU A  76
 None
 1.06A 5gs4A-2p3eA:
undetectable		 5gs4A-2p3eA:
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.
2pmp 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Arabidopsis
thaliana) 		PF02542
(YgbB) 		5 LEU A  86
ALA A  83
GLU A  82
GLY A 124
LEU A 123
 None
 1.12A 5gs4A-2pmpA:
undetectable		 5gs4A-2pmpA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE

(Medicago
truncatula) 		PF00201
(UDPGT) 		5 MET A 128
THR A 131
ALA A 134
GLU A 137
ILE A  71
 None
 0.95A 5gs4A-2pq6A:
undetectable		 5gs4A-2pq6A:
19.44
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.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 LEU A  35
ALA A  36
LEU A  77
ARG A  80
MET A 108
 1CA  A 247 ( 4.4A)
1CA  A 247 (-3.6A)
1CA  A 247 ( 3.9A)
1CA  A 247 (-3.8A)
1CA  A 247 (-3.9A)
 0.75A 5gs4A-2q3yA:
27.2		 5gs4A-2q3yA:
27.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qjt NICOTINAMIDE-NUCLEOT
IDE
ADENYLYLTRANSFERASE

(Francisella
tularensis) 		no annotation 5 LEU B 329
GLU B 330
ARG B 282
ILE B 247
GLY B 290
 None
 1.08A 5gs4A-2qjtB:
undetectable		 5gs4A-2qjtB:
19.59
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.
2vf8 EXCINUCLEASE ABC
SUBUNIT A

(Deinococcus
radiodurans) 		PF00005
(ABC_tran) 		5 THR A 310
LEU A 312
LEU A 123
GLY A 141
LEU A 295
 None
 1.08A 5gs4A-2vf8A:
undetectable		 5gs4A-2vf8A:
17.00
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.
2wch GENERAL
ODORANT-BINDING
PROTEIN 1

(Bombyx mori) 		PF01395
(PBP_GOBP) 		5 MET A   5
THR A   9
LEU A  61
MET A  90
ILE A  94
 None
B7M  A1145 ( 4.1A)
B7M  A1145 ( 4.7A)
None
B7M  A1145 ( 4.5A)
 0.92A 5gs4A-2wchA:
undetectable		 5gs4A-2wchA:
22.81
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.
3a9s D-ARABINOSE
ISOMERASE

(Aeribacillus
pallidus) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		5 LEU A 547
ALA A 548
LEU A 206
ILE A 469
GLY A 474
 None
 1.17A 5gs4A-3a9sA:
undetectable		 5gs4A-3a9sA:
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		5 THR A 227
ALA A 228
LEU A 247
ARG A 235
LEU A  28
 None
 1.13A 5gs4A-3busA:
undetectable		 5gs4A-3busA:
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.
3f6t ASPARTATE
AMINOTRANSFERASE

(Lactobacillus
acidophilus) 		PF00155
(Aminotran_1_2) 		5 MET A 305
LEU A 247
ALA A 246
ILE A 176
LEU A 183
 None
 1.17A 5gs4A-3f6tA:
undetectable		 5gs4A-3f6tA:
20.49
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.
3h2s PUTATIVE NADH-FLAVIN
REDUCTASE

(Lactobacillus
paracasei) 		PF13460
(NAD_binding_10) 		5 THR A  87
LEU A  89
ALA A  86
LEU A  70
GLY A  79
 None
None
None
NDP  A 301 (-4.4A)
None
 1.04A 5gs4A-3h2sA:
undetectable		 5gs4A-3h2sA:
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.
3hly FLAVODOXIN-LIKE
DOMAIN

(Synechococcus
elongatus) 		no annotation 5 THR A 372
LEU A 370
ALA A 344
ILE A 281
GLY A 395
 None
 0.90A 5gs4A-3hlyA:
undetectable		 5gs4A-3hlyA:
23.67
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.
3isl PURINE CATABOLISM
PROTEIN PUCG

(Bacillus
subtilis) 		PF00266
(Aminotran_5) 		5 MET A  32
THR A 273
LEU A 275
ALA A 271
GLU A 270
 None
 0.99A 5gs4A-3islA:
undetectable		 5gs4A-3islA:
22.12
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.
3ius UNCHARACTERIZED
CONSERVED PROTEIN

(Ruegeria
pomeroyi) 		no annotation 5 THR A  13
ALA A  14
LEU A  21
GLY A  96
LEU A  98
 None
 1.16A 5gs4A-3iusA:
undetectable		 5gs4A-3iusA:
23.57
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.
3k1j ATP-DEPENDENT
PROTEASE LON

(Thermococcus
onnurineus) 		PF01078
(Mg_chelatase)
PF05362
(Lon_C)
PF13654
(AAA_32) 		5 MET A 321
THR A  71
LEU A 378
ILE A  53
GLY A  77
 None
ADP  A 642 (-4.6A)
ADP  A 642 (-3.9A)
None
None
 1.09A 5gs4A-3k1jA:
undetectable		 5gs4A-3k1jA:
17.05
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.
3nnk UREIDOGLYCINE-GLYOXY
LATE
AMINOTRANSFERASE

(Klebsiella
pneumoniae) 		PF00266
(Aminotran_5) 		5 MET A  32
THR A 271
LEU A 273
ALA A 269
GLU A 268
 None
 0.91A 5gs4A-3nnkA:
undetectable		 5gs4A-3nnkA:
22.46
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.
3sdi PROTEASOME COMPONENT
PRE5

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		5 LEU E  51
ALA E  50
ILE E  31
GLY E 135
LEU E 137
 None
 1.10A 5gs4A-3sdiE:
undetectable		 5gs4A-3sdiE:
23.26
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.
3sut BETA-HEXOSAMINIDASE

(Paenibacillus
sp. TS12) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		5 THR A  89
ALA A 114
ILE A  40
GLY A  57
LEU A  53
 None
 1.06A 5gs4A-3sutA:
undetectable		 5gs4A-3sutA:
17.33
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.
3swh PROTEIN UNC-13
HOMOLOG A

(Rattus
norvegicus) 		PF10540
(Membr_traf_MHD) 		5 LEU A1477
ALA A1357
MET A1399
ILE A1403
GLY A1333
 None
 1.18A 5gs4A-3swhA:
undetectable		 5gs4A-3swhA:
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.
3tzt GLYCOSYL TRANSFERASE
FAMILY 8

(Anaerococcus
prevotii) 		PF01501
(Glyco_transf_8) 		5 LEU A   5
ALA A   4
LEU A 118
ILE A 122
LEU A 163
 None
EDO  A 302 (-4.5A)
EDO  A 302 (-4.3A)
None
None
 1.00A 5gs4A-3tztA:
undetectable		 5gs4A-3tztA:
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.
3uoe DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF02615
(Ldh_2) 		5 THR A 316
ALA A 314
LEU A  34
ARG A   9
GLY A  40
 None
 1.09A 5gs4A-3uoeA:
undetectable		 5gs4A-3uoeA:
24.13
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.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		5 MET A1011
THR A1015
LEU A1017
ALA A1018
GLY A 936
 None
 1.04A 5gs4A-3w9hA:
undetectable		 5gs4A-3w9hA:
13.51
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.
3w9i MULTIDRUG RESISTANCE
PROTEIN MEXB

(Pseudomonas
aeruginosa) 		PF00873
(ACR_tran) 		5 MET A1009
THR A1013
LEU A1015
ALA A1016
GLY A 935
 None
 1.17A 5gs4A-3w9iA:
3.0		 5gs4A-3w9iA:
13.53
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.
3wdo MFS TRANSPORTER

(Escherichia
coli) 		PF07690
(MFS_1) 		5 ALA A 119
MET A 137
ILE A 140
GLY A  18
LEU A  17
 None
 1.11A 5gs4A-3wdoA:
undetectable		 5gs4A-3wdoA:
19.77
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides) 		PF04244
(DPRP) 		5 THR A 354
LEU A 357
ALA A 358
LEU A 263
ARG A 193
 None
None
None
FAD  A1509 (-4.4A)
None
 0.98A 5gs4A-3zxsA:
undetectable		 5gs4A-3zxsA:
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.
4ayx ATP-BINDING CASSETTE
SUB-FAMILY B MEMBER
10

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 LEU A 314
MET A 436
LEU A 435
ILE A 196
GLY A 193
 None
 1.15A 5gs4A-4ayxA:
3.1		 5gs4A-4ayxA:
17.11
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.
4b8s ADP-DEPENDENT
GLUCOKINASE

(Thermococcus
litoralis) 		PF04587
(ADP_PFK_GK) 		5 ALA A 281
GLU A 308
MET A 125
ILE A 124
GLY A 120
 GOL  A1468 ( 3.9A)
GOL  A1468 (-2.9A)
None
None
GLC  A 468 (-3.6A)
 0.96A 5gs4A-4b8sA:
undetectable		 5gs4A-4b8sA:
19.14
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		5 LEU A 357
ALA A 356
LEU A  35
GLY A 399
LEU A 397
 None
 0.94A 5gs4A-4ccdA:
undetectable		 5gs4A-4ccdA:
16.48
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.
4cza NA+/H+ ANTIPORTER,
PUTATIVE

(Pyrococcus
abyssi) 		PF00999
(Na_H_Exchanger) 		5 THR A 341
LEU A 339
ALA A 340
ILE A 126
GLY A 127
 None
 1.17A 5gs4A-4czaA:
undetectable		 5gs4A-4czaA:
21.85
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.
4dnh UNCHARACTERIZED
PROTEIN

(Sinorhizobium
meliloti) 		PF06187
(DUF993) 		5 THR A 376
LEU A 374
ALA A 375
GLY A  21
LEU A  19
 None
 0.90A 5gs4A-4dnhA:
undetectable		 5gs4A-4dnhA:
21.78
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.
4e8b RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E

(Escherichia
coli) 		PF04452
(Methyltrans_RNA) 		5 THR A 227
LEU A 229
ALA A 228
ILE A 179
LEU A 171
 None
 1.19A 5gs4A-4e8bA:
undetectable		 5gs4A-4e8bA:
23.63
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.
4fxd DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 THR A 778
LEU A 780
ALA A 781
LEU A 945
GLY A 791
 None
 1.05A 5gs4A-4fxdA:
undetectable		 5gs4A-4fxdA:
13.69
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.
4j34 KYNURENINE
3-MONOOXYGENASE

(Saccharomyces
cerevisiae) 		PF01494
(FAD_binding_3) 		5 LEU A  19
ALA A  20
LEU A  62
GLY A 330
LEU A 312
 None
 1.10A 5gs4A-4j34A:
undetectable		 5gs4A-4j34A:
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.
4jc2 ASFP504

(Alcyonium) 		PF01353
(GFP) 		5 GLU A 211
ARG A  66
MET A  14
GLY A  27
LEU A  42
 CRQ  A  64 ( 3.8A)
CRQ  A  64 ( 4.3A)
None
None
None
 1.18A 5gs4A-4jc2A:
undetectable		 5gs4A-4jc2A:
23.86
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.
4jfc ENOYL-COA HYDRATASE

(Polaromonas sp.
JS666) 		PF00378
(ECH_1) 		5 ALA A 109
LEU A  27
ILE A  91
GLY A 145
LEU A 118
 None
 1.10A 5gs4A-4jfcA:
undetectable		 5gs4A-4jfcA:
23.08
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.
4jnc BIFUNCTIONAL EPOXIDE
HYDROLASE 2

(Homo sapiens) 		PF00561
(Abhydrolase_1) 		5 THR A 360
LEU A 358
LEU A 489
MET A 507
ILE A 511
 1LF  A 601 ( 4.0A)
None
None
None
None
 1.16A 5gs4A-4jncA:
undetectable		 5gs4A-4jncA:
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.
4k2b NTD BIOSYNTHESIS
OPERON PROTEIN NTDA

(Bacillus
subtilis) 		PF01041
(DegT_DnrJ_EryC1) 		5 LEU A 159
ALA A 160
ILE A 220
GLY A 132
LEU A 134
 None
 0.93A 5gs4A-4k2bA:
undetectable		 5gs4A-4k2bA:
20.93
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.
4kss TYPE II SECRETION
SYSTEM PROTEIN E,
HEMOLYSIN-COREGULATE
D PROTEIN

(Pseudomonas
aeruginosa;
Vibrio cholerae) 		PF00437
(T2SSE)
PF05638
(T6SS_HCP) 		5 THR A 357
LEU A 447
ILE A 253
GLY A 277
LEU A 274
 None
 1.17A 5gs4A-4kssA:
undetectable		 5gs4A-4kssA:
18.31
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.
4l4y TRANSCRIPTIONAL
REGULATOR LSRR

(Escherichia
coli) 		PF04198
(Sugar-bind) 		5 LEU A 120
ALA A 206
ILE A 172
GLY A 267
LEU A 268
 None
 1.15A 5gs4A-4l4yA:
undetectable		 5gs4A-4l4yA:
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.
4l5i TRANSCRIPTIONAL
REGULATOR LSRR

(Escherichia
coli) 		PF04198
(Sugar-bind) 		5 LEU A 120
ALA A 206
ILE A 172
GLY A 267
LEU A 268
 None
 1.17A 5gs4A-4l5iA:
undetectable		 5gs4A-4l5iA:
22.19
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.
4log MALTOSE ABC
TRANSPORTER
PERIPLASMIC PROTEIN
AND NR2E3 PROTEIN
CHIMERIC CONSTRUCT

(Escherichia
coli;
Homo sapiens) 		PF00104
(Hormone_recep)
PF13416
(SBP_bac_8) 		5 THR A1294
LEU A1295
ALA A1296
GLU A1299
LEU A1388
 None
 1.13A 5gs4A-4logA:
14.7		 5gs4A-4logA:
15.95
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.
4lt6 POLY(A) POLYMERASE
GAMMA

(Homo sapiens) 		PF01909
(NTP_transf_2)
PF04926
(PAP_RNA-bind)
PF04928
(PAP_central) 		5 THR A  98
LEU A 116
ALA A 115
GLY A  65
LEU A  64
 None
 0.95A 5gs4A-4lt6A:
undetectable		 5gs4A-4lt6A:
18.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		6 LEU A 286
ALA A 287
GLU A 290
ARG A 331
ILE A 361
GLY A 444
 None
 1.37A 5gs4A-4n1yA:
29.9		 5gs4A-4n1yA:
39.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		6 LEU A 286
ALA A 287
GLU A 290
ARG A 331
ILE A 361
GLY A 447
 None
 0.60A 5gs4A-4n1yA:
29.9		 5gs4A-4n1yA:
39.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		6 LEU A 286
ALA A 287
GLU A 290
ARG A 331
MET A 358
ILE A 361
 None
 0.85A 5gs4A-4n1yA:
29.9		 5gs4A-4n1yA:
39.36
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.
4nte DEPH

(Chromobacterium
violaceum) 		PF07992
(Pyr_redox_2) 		5 MET A 256
LEU A 109
ALA A 110
LEU A 229
GLY A 273
 None
None
None
None
NA  A 302 (-3.5A)
 1.09A 5gs4A-4nteA:
undetectable		 5gs4A-4nteA:
23.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 MET A 560
LEU A 566
LEU A 608
ARG A 611
MET A 639
 MOF  A 801 (-3.9A)
MOF  A 801 ( 4.6A)
MOF  A 801 ( 4.6A)
MOF  A 801 (-4.2A)
MOF  A 801 (-3.7A)
 1.14A 5gs4A-4p6wA:
26.2		 5gs4A-4p6wA:
30.42
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.
4pht GENERAL SECRETORY
PATHWAY PROTEIN E

(Vibrio
vulnificus) 		PF00437
(T2SSE) 		5 THR A 353
LEU A 443
ILE A 249
GLY A 273
LEU A 270
 None
 1.17A 5gs4A-4phtA:
undetectable		 5gs4A-4phtA:
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.
4q3k MGS-M1

(unidentified) 		PF00326
(Peptidase_S9)
PF07859
(Abhydrolase_3) 		5 THR A 120
LEU A 122
ALA A 123
LEU A  37
LEU A 135
 None
 1.16A 5gs4A-4q3kA:
undetectable		 5gs4A-4q3kA:
21.98
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.
4q6p CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF17033
(Peptidase_M99)
PF17129
(Peptidase_M99_C)
PF17130
(Peptidase_M99_m) 		5 THR A  56
LEU A  58
ALA A  55
LEU A 229
MET A  81
 None
 1.08A 5gs4A-4q6pA:
undetectable		 5gs4A-4q6pA:
20.33
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.
4qg5 PUTATIVE
PHOSPHOGLUCOMUTASE

(Leishmania
major) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A 365
ALA A 364
LEU A 393
ILE A 500
GLY A 387
 None
 1.19A 5gs4A-4qg5A:
undetectable		 5gs4A-4qg5A:
18.57
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 5 GLU A 453
LEU A 341
ARG A 357
ILE A 478
GLY A 465
 None
 1.19A 5gs4A-4r1dA:
undetectable		 5gs4A-4r1dA:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgz XAA-PRO
AMINOPEPTIDASE

(Thermococcus
sibiricus) 		no annotation 5 MET A   6
GLU A  72
ILE A 308
GLY A 236
LEU A 235
 None
 1.13A 5gs4A-4rgzA:
undetectable		 5gs4A-4rgzA:
19.51
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.
4tza FLUORESCENT PROTEIN

(synthetic
construct) 		no annotation 5 GLU C 211
ARG C  66
MET C  14
GLY C  27
LEU C  42
 CRQ  C  62 ( 3.5A)
CRQ  C  62 ( 4.2A)
None
None
None
 1.16A 5gs4A-4tzaC:
undetectable		 5gs4A-4tzaC:
21.58
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.
4z3n PUTATIVE DRUG/SODIUM
ANTIPORTER

(Escherichia
coli) 		PF01554
(MatE) 		5 LEU A 453
ALA A 450
LEU A 407
ILE A 416
GLY A 442
 None
 1.06A 5gs4A-4z3nA:
undetectable		 5gs4A-4z3nA:
18.24
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.
5all SOLUBLE EPOXIDE
HYDROLASE

(Homo sapiens) 		PF00561
(Abhydrolase_1)
PF13419
(HAD_2) 		5 THR A 360
LEU A 358
LEU A 489
MET A 507
ILE A 511
 SO4  A1550 ( 4.0A)
None
None
None
None
 1.15A 5gs4A-5allA:
undetectable		 5gs4A-5allA:
18.05
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.
5e7s LON PROTEASE

(Meiothermus
taiwanensis) 		PF05362
(Lon_C) 		5 THR A 608
LEU A 609
ALA A 724
ILE A 715
GLY A 717
 None
 1.16A 5gs4A-5e7sA:
undetectable		 5gs4A-5e7sA:
21.91
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.
5f4j PROTRUDING DOMAIN OF
GII.17 NOROVIRUS
CAPSID

(Norwalk virus) 		PF08435
(Calici_coat_C) 		5 LEU A 249
LEU A 237
ILE A 458
GLY A 264
LEU A 452
 None
 1.17A 5gs4A-5f4jA:
undetectable		 5gs4A-5f4jA:
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.
5gz1 MESO-DIAMINOPIMELATE
D-DEHYDROGENASE

(Ureibacillus
thermosphaericus) 		PF01113
(DapB_N)
PF16654
(DAPDH_C) 		5 ALA A 283
ARG A 289
ILE A   8
GLY A  15
LEU A  14
 None
 1.10A 5gs4A-5gz1A:
undetectable		 5gs4A-5gz1A:
22.48
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.
5ikn DNA PRIMASE/HELICASE

(Escherichia
virus T7) 		PF03796
(DnaB_C)
PF13155
(Toprim_2) 		5 MET D 309
THR D 311
ILE D 442
GLY D 488
LEU D 486
 None
 1.02A 5gs4A-5iknD:
undetectable		 5gs4A-5iknD:
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.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		5 ALA A1016
GLU A1053
MET A1441
ILE A1486
GLY A 973
 None
None
None
GLC  A1708 ( 4.2A)
GLC  A1708 ( 3.5A)
 1.08A 5gs4A-5jbeA:
undetectable		 5gs4A-5jbeA:
13.48
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.
5kte DIVALENT METAL
CATION TRANSPORTER
MNTH

(Deinococcus
radiodurans) 		PF01566
(Nramp) 		5 THR A 130
LEU A 132
ALA A 133
LEU A 376
GLY A 226
 None
 0.62A 5gs4A-5kteA:
undetectable		 5gs4A-5kteA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mac RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE-OXYGENAS
E TYPE III

(Methanococcoides
burtonii) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 LEU A 315
ALA A 316
LEU A 109
ILE A 266
GLY A 265
 None
 1.07A 5gs4A-5macA:
undetectable		 5gs4A-5macA:
19.19
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.
5me3 SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF12765
(Cohesin_HEAT)
PF12830
(Nipped-B_C) 		5 THR A1054
LEU A1052
ALA A1053
ILE A1098
LEU A1086
 None
 0.96A 5gs4A-5me3A:
undetectable		 5gs4A-5me3A:
12.64
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
POTASSIUM-BINDING
SUBUNIT

(Escherichia
coli) 		PF03814
(KdpA) 		5 LEU A 261
ALA A  20
LEU A  27
GLY A 280
LEU A 284
 None
 1.07A 5gs4A-5mrwA:
undetectable		 5gs4A-5mrwA:
18.10
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.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 5 LEU A 772
ALA A 773
LEU A 814
ARG A 817
MET A 845
 ECV  A1101 ( 3.9A)
ECV  A1101 (-3.8A)
ECV  A1101 (-4.1A)
ECV  A1101 (-4.0A)
ECV  A1101 (-4.0A)
 0.84A 5gs4A-5mwpA:
26.7		 5gs4A-5mwpA:
16.23
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.
5o0j ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
horikoshii) 		no annotation 5 ALA A 271
GLU A 298
MET A 120
ILE A 119
GLY A 115
 None
8BR  A 501 ( 4.6A)
None
None
GLC  A 503 (-3.7A)
 1.11A 5gs4A-5o0jA:
undetectable		 5gs4A-5o0jA:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE

(Methanocaldococcus
jannaschii) 		no annotation 5 ALA A  22
LEU A  19
ILE A 267
GLY A 223
LEU A 219
 None
 1.16A 5gs4A-5od2A:
undetectable		 5gs4A-5od2A:
14.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 MET A 294
LEU A 301
GLU A 305
MET A 340
LEU A 343
ARG A 346
 None
EST  A 601 ( 4.3A)
EST  A 601 (-2.4A)
EST  A 601 ( 4.8A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.1A)
 1.31A 5gs4A-5toaA:
30.8		 5gs4A-5toaA:
59.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 MET A 295
THR A 299
LEU A 301
ALA A 302
GLU A 305
MET A 340
LEU A 343
ARG A 346
ILE A 376
GLY A 472
LEU A 476
 EST  A 601 ( 4.4A)
None
EST  A 601 ( 4.3A)
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
EST  A 601 ( 4.8A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.1A)
EST  A 601 ( 4.4A)
EST  A 601 (-4.0A)
EST  A 601 (-3.5A)
 0.46A 5gs4A-5toaA:
30.8		 5gs4A-5toaA:
59.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 THR A 299
LEU A 301
ALA A 302
GLU A 305
ARG A 346
ILE A 373
LEU A 476
 None
EST  A 601 ( 4.3A)
EST  A 601 ( 3.9A)
EST  A 601 (-2.4A)
EST  A 601 (-4.1A)
None
EST  A 601 (-3.5A)
 1.20A 5gs4A-5toaA:
30.8		 5gs4A-5toaA:
59.84
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.
5tpr 3-DEHYDROQUINATE
SYNTHASE

(Trichormus
variabilis) 		PF01761
(DHQ_synthase) 		5 THR A 186
LEU A 187
LEU A 148
ILE A  33
GLY A  32
 NAD  A 503 (-4.0A)
NAD  A 503 (-4.4A)
None
None
None
 1.16A 5gs4A-5tprA:
undetectable		 5gs4A-5tprA:
20.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		5 MET A  29
LEU A  35
LEU A  77
ARG A  80
MET A 108
 1TA  A 301 ( 2.9A)
1TA  A 301 ( 3.6A)
1TA  A 301 ( 3.4A)
1TA  A 301 (-3.5A)
1TA  A 301 ( 3.0A)
 0.85A 5gs4A-5ufsA:
27.0		 5gs4A-5ufsA:
30.66
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.
5x03 HTH-TYPE
TRANSCRIPTIONAL
REGULATORY PROTEIN
GABR

(Bacillus
subtilis) 		PF00155
(Aminotran_1_2) 		5 THR A 159
LEU A 161
LEU A 351
ILE A 151
GLY A 150
 None
 1.16A 5gs4A-5x03A:
undetectable		 5gs4A-5x03A:
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.
5xdr PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE DHX15

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		5 ALA A 563
LEU A 242
ILE A 519
GLY A 518
LEU A 555
 None
 1.09A 5gs4A-5xdrA:
undetectable		 5gs4A-5xdrA:
16.69
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.
5xdr PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE DHX15

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		5 MET A 273
THR A 269
LEU A 267
LEU A 503
GLY A 298
 None
 1.10A 5gs4A-5xdrA:
undetectable		 5gs4A-5xdrA:
16.69
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.
5xmm MHC CLASS I ANTIGEN
ALPHA CHAIN

(Felis catus) 		no annotation 5 THR A 188
LEU A 207
ALA A 206
GLY A 266
LEU A 267
 None
 1.07A 5gs4A-5xmmA:
undetectable		 5gs4A-5xmmA:
18.44
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.
5xx9 BACTERIOFERRITIN

(Streptomyces
coelicolor) 		no annotation 5 LEU A  19
LEU A  58
ILE A   8
GLY A  67
LEU A  68
 None
 1.11A 5gs4A-5xx9A:
undetectable		 5gs4A-5xx9A:
21.67
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.
6dk2 -

(-) 		no annotation 5 ALA A 496
LEU A 555
ILE A 143
GLY A 133
LEU A 135
 None
 1.18A 5gs4A-6dk2A:
undetectable		 5gs4A-6dk2A:
undetectable