SIMILAR PATTERNS OF AMINO ACIDS FOR 3HS6_B_EPAB1_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.
1b88 T CELL RECEPTOR
V-ALPHA DOMAIN

(Mus musculus) 		PF07686
(V-set) 		5 PHE A  66
ILE A  50
PHE A  33
TYR A  25
ALA A  94
 None
 1.00A 3hs6B-1b88A:
undetectable		 3hs6B-1b88A:
10.49
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.
1bxn PROTEIN (RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN)
PROTEIN (RIBULOSE
BISPHOSPHATE
CARBOXYLASE SMALL
CHAIN)

(Cupriavidus
necator) 		PF00016
(RuBisCO_large)
PF00101
(RuBisCO_small)
PF02788
(RuBisCO_large_N) 		5 TYR I 123
ILE A 409
GLY A 189
GLY A 195
LEU A 196
 None
 0.96A 3hs6B-1bxnI:
undetectable		 3hs6B-1bxnI:
12.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		11 PHE A 209
GLY A 227
TYR A 355
ASN A 375
ILE A 377
PHE A 381
TYR A 385
GLY A 526
ALA A 527
GLY A 533
LEU A 534
 None
None
SCL  A 700 (-4.3A)
None
None
OAS  A 530 ( 4.7A)
None
SCL  A 700 ( 4.0A)
SCL  A 700 (-2.9A)
OAS  A 530 ( 4.0A)
OAS  A 530 ( 3.3A)
 0.38A 3hs6B-1ebvA:
30.3		 3hs6B-1ebvA:
63.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		6 PHE A 210
TYR A 355
ILE A 377
PHE A 381
GLY A 526
ALA A 527
 HEM  A 601 (-4.7A)
SCL  A 700 (-4.3A)
None
OAS  A 530 ( 4.7A)
SCL  A 700 ( 4.0A)
SCL  A 700 (-2.9A)
 1.34A 3hs6B-1ebvA:
30.3		 3hs6B-1ebvA:
63.80
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.
1gae D-GLYCERALDEHYDE-3-P
HOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR O 311
ASN O 222
GLY O 209
ALA O 210
GLY O 215
 None
 0.95A 3hs6B-1gaeO:
0.0		 3hs6B-1gaeO:
20.61
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.
1h3g CYCLOMALTODEXTRINASE

(Flavobacterium
sp. 92) 		PF00128
(Alpha-amylase)
PF09087
(Cyc-maltodext_N)
PF10438
(Cyc-maltodext_C) 		5 ASN A 409
ILE A 446
PHE A 103
GLY A 307
LEU A 366
 None
 1.02A 3hs6B-1h3gA:
0.0		 3hs6B-1h3gA:
20.12
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.
1jd3 CHORISMATE LYASE

(Escherichia
coli) 		PF04345
(Chor_lyase) 		5 TYR A 164
GLY A 136
ALA A 135
GLY A 132
LEU A  11
 None
 0.92A 3hs6B-1jd3A:
0.0		 3hs6B-1jd3A:
17.34
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 PHE A 946
GLY A 945
ASN A 567
GLY A 597
SER A 599
 None
 1.02A 3hs6B-1kqfA:
0.0		 3hs6B-1kqfA:
21.31
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.
1o5h FORMIMINOTETRAHYDROF
OLATE CYCLODEAMINASE

(Thermotoga
maritima) 		PF04961
(FTCD_C) 		5 GLY A  25
ALA A  26
SER A  29
GLY A  32
LEU A  73
 None
 0.79A 3hs6B-1o5hA:
undetectable		 3hs6B-1o5hA:
16.89
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.
1q5q PROTEASOME
ALPHA-TYPE SUBUNIT 1

(Rhodococcus
erythropolis) 		PF00227
(Proteasome) 		5 GLY A  66
ILE A  24
GLY A 145
ALA A 104
LEU A  74
 None
 1.02A 3hs6B-1q5qA:
0.0		 3hs6B-1q5qA:
17.94
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.
1qgz PROTEIN
(FERREDOXIN:NADP+
REDUCTASE)

(Nostoc sp. PCC
7119) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 GLY A  23
ILE A 132
TYR A  54
ALA A  82
SER A  96
 None
 1.02A 3hs6B-1qgzA:
undetectable		 3hs6B-1qgzA:
20.28
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.
1rcw CT610

(Chlamydia
trachomatis) 		PF03070
(TENA_THI-4) 		5 GLY A  33
TYR A  27
ALA A 149
GLY A 155
LEU A 156
 None
 0.98A 3hs6B-1rcwA:
undetectable		 3hs6B-1rcwA:
17.80
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.
1u3h T-CELL RECEPTOR
ALPHA-CHAIN

(Mus musculus) 		PF07686
(V-set) 		5 PHE A  66
ILE A  49
PHE A  32
TYR A  24
ALA A  98
 None
 0.94A 3hs6B-1u3hA:
undetectable		 3hs6B-1u3hA:
10.40
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.
1uc4 DIOL DEHYDRASE ALPHA
SUBUNIT

(Klebsiella
oxytoca) 		PF02286
(Dehydratase_LU) 		5 ILE A 492
GLY A 193
ALA A 159
SER A 190
LEU A 186
 None
 0.92A 3hs6B-1uc4A:
undetectable		 3hs6B-1uc4A:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vkz PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Thermotoga
maritima) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		6 TYR A 326
ASN A  44
GLY A  13
ALA A 347
SER A  11
GLY A  34
 None
 1.48A 3hs6B-1vkzA:
undetectable		 3hs6B-1vkzA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 TYR A 402
ASN A 306
GLY A  10
GLY A 362
LEU A 353
 None
SUG  A1001 ( 4.1A)
None
None
None
 1.02A 3hs6B-1yniA:
undetectable		 3hs6B-1yniA:
22.85
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.
2b5o FERREDOXIN--NADP
REDUCTASE

(Synechococcus
sp. PCC 7002) 		PF00175
(NAD_binding_1) 		5 GLY A 125
ILE A 235
TYR A 156
ALA A 184
SER A 198
 None
 0.99A 3hs6B-2b5oA:
undetectable		 3hs6B-2b5oA:
21.12
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.
2d4y FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 1

(Salmonella
enterica) 		no annotation 5 GLY A 280
GLY A  76
ALA A  77
GLY A  83
LEU A  84
 None
 0.82A 3hs6B-2d4yA:
0.2		 3hs6B-2d4yA:
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.
2d4y FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 1

(Salmonella
enterica) 		no annotation 5 GLY A 281
GLY A  76
ALA A  77
GLY A  83
LEU A  84
 None
 0.69A 3hs6B-2d4yA:
0.2		 3hs6B-2d4yA:
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.
2dgj HYPOTHETICAL PROTEIN
EBHA

(Staphylococcus
aureus) 		PF01468
(GA) 		5 ASN A 137
GLY A 127
ALA A 128
SER A 131
GLY A 134
 None
 0.89A 3hs6B-2dgjA:
undetectable		 3hs6B-2dgjA:
16.64
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.
2ood BLR3880 PROTEIN

(Bradyrhizobium
diazoefficiens) 		PF01979
(Amidohydro_1) 		5 PHE A 378
GLY A 377
PHE A  75
GLY A 131
ALA A 130
 None
 0.89A 3hs6B-2oodA:
undetectable		 3hs6B-2oodA:
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.
2p10 MLL9387 PROTEIN

(Mesorhizobium
japonicum) 		PF09370
(PEP_hydrolase) 		5 GLY A  35
GLY A  46
ALA A  45
SER A  42
LEU A  38
 None
 0.99A 3hs6B-2p10A:
undetectable		 3hs6B-2p10A:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v6o THIOREDOXIN
GLUTATHIONE
REDUCTASE

(Schistosoma
mansoni) 		PF00462
(Glutaredoxin)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A  56
ASN A  55
ILE A  59
GLY A 459
ALA A 460
 None
None
None
PG4  A1596 ( 4.6A)
None
 0.90A 3hs6B-2v6oA:
undetectable		 3hs6B-2v6oA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vsg VARIANT SURFACE
GLYCOPROTEIN ILTAT
1.24

(Trypanosoma
brucei) 		PF00913
(Trypan_glycop) 		5 PHE A 306
GLY A 307
ASN A 312
ILE A 313
ALA A  61
 None
 1.03A 3hs6B-2vsgA:
undetectable		 3hs6B-2vsgA:
18.59
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.
2z5l TYLACTONE SYNTHASE
STARTER MODULE AND
MODULES 1 & 2

(Streptomyces
fradiae) 		PF08659
(KR) 		5 GLY A 251
ILE A 243
ALA A 297
SER A 270
GLY A 245
 None
 1.02A 3hs6B-2z5lA:
undetectable		 3hs6B-2z5lA:
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.
3abb CYTOCHROME P450
HYDROXYLASE

(Streptomyces
avermitilis) 		PF00067
(p450) 		5 ILE A 388
TYR A  24
GLY A 255
ALA A 256
LEU A 379
 None
 1.03A 3hs6B-3abbA:
0.0		 3hs6B-3abbA:
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.
3c8t FUMARATE LYASE

(Chelativorans
sp. BNC1) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 PHE A 173
GLY A 174
TYR A 350
GLY A 358
LEU A 147
 None
 0.82A 3hs6B-3c8tA:
undetectable		 3hs6B-3c8tA:
20.66
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.
3dh9 THIOREDOXIN
REDUCTASE 1

(Drosophila
melanogaster) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 PHE A 181
PHE A 205
GLY A 204
ALA A 203
LEU A 282
 None
 1.00A 3hs6B-3dh9A:
undetectable		 3hs6B-3dh9A:
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.
3dmc NTF2-LIKE PROTEIN

(Trichormus
variabilis) 		PF12680
(SnoaL_2) 		5 PHE A  63
PHE A  32
GLY A  16
GLY A  23
LEU A  24
 None
 1.01A 3hs6B-3dmcA:
undetectable		 3hs6B-3dmcA:
13.30
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.
3e4w PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF00199
(Catalase) 		5 GLY A  79
ASN A  66
GLY A  19
ALA A  26
GLY A  67
 None
None
None
HEM  A 501 (-3.4A)
HEZ  A1100 ( 3.7A)
 1.02A 3hs6B-3e4wA:
undetectable		 3hs6B-3e4wA:
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.
3hf9 PROTEASOME (ALPHA
SUBUNIT) PRCA

(Mycobacterium
tuberculosis) 		no annotation 5 GLY A  66
ILE A  24
GLY A 145
ALA A 104
LEU A  74
 None
 0.95A 3hs6B-3hf9A:
undetectable		 3hs6B-3hf9A:
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.
3hig AMILORIDE-SENSITIVE
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		5 GLY A 498
ASN A 508
ILE A 506
GLY A 240
GLY A 361
 None
 1.00A 3hs6B-3higA:
undetectable		 3hs6B-3higA:
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.
3jcu CHLOROPHYLL A-B
BINDING PROTEIN 29
KD (CP29)

(Spinacia
oleracea) 		PF00504
(Chloroa_b-bind) 		5 PHE R 211
GLY R 207
ALA R 204
GLY R 109
LEU R 108
 LUT  R 620 (-3.8A)
LUT  R 620 (-3.9A)
LUT  R 620 (-3.5A)
CLA  R 604 (-3.2A)
CLA  R 604 (-4.4A)
 1.01A 3hs6B-3jcuR:
undetectable		 3hs6B-3jcuR:
17.51
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.
3mhp FERREDOXIN--NADP
REDUCTASE, LEAF
ISOZYME,
CHLOROPLASTIC

(Pisum sativum) 		PF00175
(NAD_binding_1) 		5 GLY A  34
ILE A 141
TYR A  64
ALA A  92
SER A 106
 None
 1.00A 3hs6B-3mhpA:
undetectable		 3hs6B-3mhpA:
18.95
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.
3mkt MULTI ANTIMICROBIAL
EXTRUSION PROTEIN
(NA(+)/DRUG
ANTIPORTER)
MATE-LIKE MDR EFFLUX
PUMP

(Vibrio cholerae) 		PF01554
(MatE) 		5 GLY A 295
GLY A 313
ALA A 315
GLY A 321
LEU A 322
 None
 0.90A 3hs6B-3mktA:
undetectable		 3hs6B-3mktA:
21.68
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.
3ntn USPA1

(Moraxella
catarrhalis) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A 224
ASN A 227
ILE A 237
GLY A 270
SER A 255
 None
 0.99A 3hs6B-3ntnA:
undetectable		 3hs6B-3ntnA:
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.
3ozz CYTOCHROME B5

(Bos taurus) 		PF00173
(Cyt-b5) 		5 GLY B  77
ILE B  76
GLY B  51
ALA B  52
LEU B  79
 None
 0.98A 3hs6B-3ozzB:
undetectable		 3hs6B-3ozzB:
9.90
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.
3pe8 ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		5 ASN A  96
ILE A  95
GLY A  65
ALA A  28
GLY A  57
 None
 0.82A 3hs6B-3pe8A:
undetectable		 3hs6B-3pe8A:
17.39
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.
3pfe SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Legionella
pneumophila) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 TYR A 196
ILE A  53
GLY A 127
ALA A 128
LEU A 189
 GOL  A 522 ( 4.8A)
None
None
None
None
 0.96A 3hs6B-3pfeA:
undetectable		 3hs6B-3pfeA:
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.
3pr7 USPA1

(Moraxella
catarrhalis) 		PF05658
(YadA_head)
PF05662
(YadA_stalk) 		5 GLY A 224
ASN A 227
ILE A 237
GLY A 270
SER A 255
 None
 1.02A 3hs6B-3pr7A:
undetectable		 3hs6B-3pr7A:
19.33
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.
3qyr ECHA16_2

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 ASN A  95
ILE A  94
GLY A  64
ALA A  27
GLY A  56
 None
 0.81A 3hs6B-3qyrA:
undetectable		 3hs6B-3qyrA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vab DIAMINOPIMELATE
DECARBOXYLASE 1

(Brucella
melitensis) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 ILE A  22
GLY A 286
ALA A 285
SER A  34
GLY A 395
 None
 0.90A 3hs6B-3vabA:
undetectable		 3hs6B-3vabA:
20.44
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.
3vo2 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Zea mays) 		PF00175
(NAD_binding_1) 		5 GLY A  40
ILE A 147
TYR A  70
ALA A  98
SER A 112
 None
 1.00A 3hs6B-3vo2A:
undetectable		 3hs6B-3vo2A:
19.35
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.
3vpx LEUCINE
DEHYDROGENASE

(Sporosarcina
psychrophila) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 PHE A  99
GLY A 100
ILE A 126
ALA A  39
LEU A 106
 None
 1.03A 3hs6B-3vpxA:
undetectable		 3hs6B-3vpxA:
19.02
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.
3wo8 BETA-N-ACETYLGLUCOSA
MINIDASE

(Thermotoga
maritima) 		PF00933
(Glyco_hydro_3) 		5 GLY A 100
GLY A 143
ALA A 144
GLY A 149
LEU A 151
 None
 0.92A 3hs6B-3wo8A:
0.0		 3hs6B-3wo8A:
21.37
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.
3wyh LYSOZYME G

(Struthio
camelus) 		PF01464
(SLT) 		6 GLY A 105
TYR A 180
GLY A  77
ALA A  76
GLY A 109
LEU A 113
 None
 1.21A 3hs6B-3wyhA:
undetectable		 3hs6B-3wyhA:
15.21
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.
4ain GLYCINE BETAINE
TRANSPORTER BETP

(Corynebacterium
glutamicum) 		PF02028
(BCCT) 		5 GLY A 255
GLY A 496
ALA A 498
GLY A 503
LEU A 504
 None
 0.98A 3hs6B-4ainA:
undetectable		 3hs6B-4ainA:
18.83
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.
4ain GLYCINE BETAINE
TRANSPORTER BETP

(Corynebacterium
glutamicum) 		PF02028
(BCCT) 		5 GLY A 454
GLY A 257
ALA A 258
GLY A 264
LEU A 265
 None
 0.86A 3hs6B-4ainA:
undetectable		 3hs6B-4ainA:
18.83
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		5 GLY A 551
GLY A 630
ALA A 631
GLY A 636
LEU A 638
 None
 1.01A 3hs6B-4av6A:
undetectable		 3hs6B-4av6A:
22.16
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.
4bgb PUTATIVE SUGAR
KINASE MK0840

(Methanopyrus
kandleri) 		PF03702
(AnmK) 		5 PHE A 182
GLY A 137
GLY A 329
ALA A 327
GLY A 145
 None
 1.01A 3hs6B-4bgbA:
undetectable		 3hs6B-4bgbA:
18.78
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.
4bju N-ACETYLGLUCOSAMINE-
PHOSPHATE MUTASE

(Aspergillus
fumigatus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I) 		5 GLY A 138
ILE A 142
GLY A  47
ALA A  45
LEU A  39
 None
 0.93A 3hs6B-4bjuA:
0.6		 3hs6B-4bjuA:
24.16
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.
4dbh 2-HYDROXYHEPTA-2,4-D
IENE-1,7-DIOATE
ISOMERASE

(Corynebacterium
glutamicum) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		5 ASN A 146
ILE A 251
GLY A 241
ALA A 240
GLY A 117
 None
 0.87A 3hs6B-4dbhA:
undetectable		 3hs6B-4dbhA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dna PROBABLE GLUTATHIONE
REDUCTASE

(Sinorhizobium
meliloti) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		6 GLY A  21
ILE A  33
TYR A  99
GLY A  41
SER A  15
GLY A  17
 None
None
None
FAD  A 500 (-3.4A)
FAD  A 500 (-3.9A)
None
 1.36A 3hs6B-4dnaA:
undetectable		 3hs6B-4dnaA:
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.
4ezd UREA TRANSPORTER 1

(Bos taurus) 		PF03253
(UT) 		5 GLY A 266
ILE A 276
ALA A 256
GLY A 262
LEU A 261
 None
 1.00A 3hs6B-4ezdA:
undetectable		 3hs6B-4ezdA:
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.
4fe1 PHOTOSYSTEM I
REACTION CENTER
SUBUNIT XI

(Thermosynechococcus
elongatus) 		PF02605
(PsaL) 		5 PHE L 124
GLY L  51
ALA L  84
GLY L  55
LEU L  58
 BCR  L1005 (-4.3A)
None
None
None
None
 0.99A 3hs6B-4fe1L:
0.7		 3hs6B-4fe1L:
13.85
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.
4izg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN

(Paracoccus
denitrificans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 309
ASN A 317
GLY A 342
SER A 134
GLY A 319
 None
 0.91A 3hs6B-4izgA:
undetectable		 3hs6B-4izgA:
21.25
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.
4j8s CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF16417
(CNOT1_TTP_bind) 		5 GLY A 944
ILE A 945
PHE A 974
ALA A 966
LEU A 929
 None
 0.97A 3hs6B-4j8sA:
undetectable		 3hs6B-4j8sA:
17.55
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.
4jgi PUTATIVE
UNCHARACTERIZED
PROTEIN

(Desulfitobacterium
hafniense) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		5 GLY A 168
ASN A 171
GLY A 191
ALA A 192
LEU A 173
 None
 0.96A 3hs6B-4jgiA:
undetectable		 3hs6B-4jgiA:
18.11
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.
4jjt ENOYL-COA HYDRATASE

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		5 ASN A  95
ILE A  94
GLY A  64
ALA A  27
GLY A  56
 None
 0.81A 3hs6B-4jjtA:
undetectable		 3hs6B-4jjtA:
19.56
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.
4k0d PERIPLASMIC SENSOR
HYBRID HISTIDINE
KINASE

(Anaeromyxobacter
dehalogenans) 		no annotation 5 PHE A 162
GLY A 107
ALA A 108
SER A 111
LEU A 115
 None
 0.99A 3hs6B-4k0dA:
undetectable		 3hs6B-4k0dA:
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.
4k9d GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Brugia malayi) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR A 319
ASN A 230
GLY A 217
ALA A 218
GLY A 223
 None
 0.92A 3hs6B-4k9dA:
undetectable		 3hs6B-4k9dA:
20.40
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.
4n5f PUTATIVE ACYL-COA
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLY A 241
ASN A 238
ILE A  54
GLY A 121
ALA A 122
 None
 1.02A 3hs6B-4n5fA:
undetectable		 3hs6B-4n5fA:
21.75
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.
4o59 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Bos taurus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR O 311
ASN O 222
GLY O 209
ALA O 210
GLY O 215
 None
 0.97A 3hs6B-4o59O:
undetectable		 3hs6B-4o59O:
18.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		9 PHE A 210
GLY A 228
TYR A 356
ASN A 376
ILE A 378
PHE A 382
ALA A 528
SER A 531
GLY A 534
 EDO  A 616 (-3.5A)
EDO  A 616 ( 4.5A)
IBP  A 601 (-4.5A)
EDO  A 616 (-4.4A)
None
None
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
EDO  A 616 (-3.0A)
 0.72A 3hs6B-4ph9A:
63.6		 3hs6B-4ph9A:
99.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		11 PHE A 210
GLY A 228
TYR A 356
ASN A 376
ILE A 378
PHE A 382
TYR A 386
GLY A 527
ALA A 528
GLY A 534
LEU A 535
 EDO  A 616 (-3.5A)
EDO  A 616 ( 4.5A)
IBP  A 601 (-4.5A)
EDO  A 616 (-4.4A)
None
None
IBP  A 601 (-4.8A)
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
EDO  A 616 (-3.0A)
EDO  A 616 ( 4.4A)
 0.38A 3hs6B-4ph9A:
63.6		 3hs6B-4ph9A:
99.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		6 PHE A 211
TYR A 356
ILE A 378
PHE A 382
ALA A 528
SER A 531
 HEM  A 602 (-4.6A)
IBP  A 601 (-4.5A)
None
None
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
 1.29A 3hs6B-4ph9A:
63.6		 3hs6B-4ph9A:
99.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		6 PHE A 211
TYR A 356
ILE A 378
PHE A 382
GLY A 527
ALA A 528
 HEM  A 602 (-4.6A)
IBP  A 601 (-4.5A)
None
None
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
 1.37A 3hs6B-4ph9A:
63.6		 3hs6B-4ph9A:
99.28
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.
4rcd BETA-SECRETASE 1

(Homo sapiens) 		PF00026
(Asp) 		5 TYR A 190
ASN A   5
ILE A  87
GLY A 177
LEU A 152
 None
 0.98A 3hs6B-4rcdA:
undetectable		 3hs6B-4rcdA:
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.
4rkc AROMATIC AMINO ACID
AMINOTRANSFERASE

(Psychrobacter
sp. B6) 		PF00155
(Aminotran_1_2) 		6 GLY A 103
ASN A 242
GLY A  70
ALA A  69
GLY A 257
LEU A 258
 PMP  A 409 (-3.4A)
None
None
None
None
None
 1.43A 3hs6B-4rkcA:
undetectable		 3hs6B-4rkcA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ug4 CHOLINE SULFATASE

(Sinorhizobium
meliloti) 		PF00884
(Sulfatase)
PF12411
(Choline_sulf_C) 		5 ILE A  83
ALA A  57
SER A  60
GLY A  64
LEU A 340
 None
 0.88A 3hs6B-4ug4A:
undetectable		 3hs6B-4ug4A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uir OLEATE HYDRATASE

(Elizabethkingia
meningoseptica) 		PF06100
(MCRA) 		5 GLY A 109
TYR A 152
ILE A 116
GLY A 120
GLY A 107
 None
None
None
P6G  A1649 ( 3.3A)
None
 1.02A 3hs6B-4uirA:
undetectable		 3hs6B-4uirA:
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.
4z0h GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
GAPC1, CYTOSOLIC

(Arabidopsis
thaliana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR O 311
ASN O 222
GLY O 209
ALA O 210
GLY O 215
 None
None
SO4  O 403 (-3.9A)
SO4  O 403 ( 3.8A)
None
 0.93A 3hs6B-4z0hO:
undetectable		 3hs6B-4z0hO:
20.85
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.
5b37 TRYPTOPHAN
DEHYDROGENASE

(Nostoc
punctiforme) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A 153
ILE A 283
ALA A 143
SER A 147
GLY A 149
 None
 0.91A 3hs6B-5b37A:
undetectable		 3hs6B-5b37A:
18.83
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.
5dtp PROBABLE ENOYL-COA
HYDRATASE ECHA6

(Mycobacterium
tuberculosis) 		PF00378
(ECH_1) 		6 ASN A  94
ILE A  93
GLY A  59
ALA A  23
GLY A  51
LEU A  15
 None
 1.12A 3hs6B-5dtpA:
undetectable		 3hs6B-5dtpA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		5 GLY A 298
PHE A 324
GLY A  75
ALA A  77
GLY A  82
 None
 0.98A 3hs6B-5gmxA:
undetectable		 3hs6B-5gmxA:
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT EPSILON
T-COMPLEX PROTEIN 1
SUBUNIT ETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		5 GLY e 118
ILE e 115
GLY h 381
ALA h 382
LEU e 107
 None
 1.02A 3hs6B-5gw5e:
undetectable		 3hs6B-5gw5e:
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		5 GLY A 899
TYR A 123
ASN A 164
SER A 161
GLY A 147
 None
 0.97A 3hs6B-5h42A:
undetectable		 3hs6B-5h42A:
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.
5i45 GLYCOSYL
TRANSFERASES GROUP 1
FAMILY PROTEIN

(Francisella
tularensis) 		PF00534
(Glycos_transf_1) 		5 ILE A 170
GLY A 280
ALA A 279
SER A 255
GLY A 179
 None
 0.96A 3hs6B-5i45A:
undetectable		 3hs6B-5i45A:
16.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		12 PHE A 209
GLY A 227
TYR A 355
ASN A 375
ILE A 377
PHE A 381
TYR A 385
GLY A 526
ALA A 527
SER A 530
GLY A 533
LEU A 534
 None
None
ID8  A 601 (-3.8A)
None
None
None
ID8  A 601 ( 3.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-2.7A)
None
None
 0.28A 3hs6B-5ikrA:
61.8		 3hs6B-5ikrA:
87.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		7 PHE A 210
TYR A 355
ILE A 377
PHE A 381
GLY A 526
ALA A 527
SER A 530
 COH  A 602 (-4.0A)
ID8  A 601 (-3.8A)
None
None
ID8  A 601 (-3.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-2.7A)
 1.30A 3hs6B-5ikrA:
61.8		 3hs6B-5ikrA:
87.10
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.
5iw1 T-CELL RECEPTOR
ALPHA CHAIN

(Mus musculus) 		PF07686
(V-set)
PF09291
(DUF1968) 		5 PHE A  67
ILE A  51
PHE A  34
TYR A  26
ALA A  95
 None
 0.99A 3hs6B-5iw1A:
undetectable		 3hs6B-5iw1A:
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.
5j9g GLYCERALDEHYDE-3-P
DEHYDROGENASE

(Lactobacillus
acidophilus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR A 318
ASN A 230
GLY A 217
ALA A 218
GLY A 223
 None
 0.87A 3hs6B-5j9gA:
undetectable		 3hs6B-5j9gA:
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.
5ld5 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Atopobium
vaginae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR A 334
ASN A 242
GLY A 229
ALA A 230
GLY A 235
 None
None
GOL  A 404 (-2.8A)
GOL  A 404 (-3.3A)
None
 0.92A 3hs6B-5ld5A:
undetectable		 3hs6B-5ld5A:
20.34
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.
5neu INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 485
ASN A 417
GLY A 348
ALA A 411
GLY A 418
 None
 1.02A 3hs6B-5neuA:
undetectable		 3hs6B-5neuA:
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.
5oy0 PHOTOSYSTEM I
REACTION CENTER
SUBUNIT XI

(Synechocystis
sp. PCC 6803) 		no annotation 5 PHE 0 127
GLY 0  54
ALA 0  87
GLY 0  58
LEU 0  61
 BCR  0 204 (-4.0A)
None
None
None
None
 0.97A 3hs6B-5oy00:
1.2		 3hs6B-5oy00:
9.40
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.
5tp4 AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY

(Burkholderia
ambifaria) 		PF01546
(Peptidase_M20) 		6 GLY A  63
ASN A  64
GLY A 146
ALA A 147
GLY A 140
LEU A 139
 None
 1.09A 3hs6B-5tp4A:
undetectable		 3hs6B-5tp4A:
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.
5ur0 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Naegleria
gruberi) 		no annotation 5 TYR A 312
ASN A 222
GLY A 209
ALA A 210
GLY A 215
 OCS  A 149 ( 4.1A)
None
None
None
None
 0.90A 3hs6B-5ur0A:
undetectable		 3hs6B-5ur0A:
11.09
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.
5vf5 SM80.1 VICILIN

(Solanum
melongena) 		no annotation 5 PHE A 162
ILE A 169
PHE A 173
TYR A 150
GLY A 142
 None
 1.02A 3hs6B-5vf5A:
undetectable		 3hs6B-5vf5A:
9.07
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.
5vft PROTEASOME SUBUNIT
BETA TYPE-4

(Homo sapiens) 		no annotation 5 GLY T  28
ILE T  39
GLY T  52
SER T  54
GLY T   8
 None
 1.01A 3hs6B-5vftT:
undetectable		 3hs6B-5vftT:
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.
5vmt GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Neisseria
gonorrhoeae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 TYR A 313
ASN A 225
GLY A 212
ALA A 213
GLY A 218
 None
 0.91A 3hs6B-5vmtA:
undetectable		 3hs6B-5vmtA:
21.12
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.
5xnz CRED

(Streptomyces
cremeus) 		no annotation 5 PHE A 163
GLY A 164
GLY A 357
ALA A 356
LEU A 137
 None
 0.73A 3hs6B-5xnzA:
undetectable		 3hs6B-5xnzA:
9.30
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.
5y37 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Streptococcus
agalactiae) 		no annotation 5 TYR A 318
ASN A 230
GLY A 217
ALA A 218
GLY A 223
 None
 0.86A 3hs6B-5y37A:
undetectable		 3hs6B-5y37A:
9.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y79 PUTATIVE HEXOSE
PHOSPHATE
TRANSLOCATOR

(Galdieria
sulphuraria) 		PF03151
(TPT) 		5 PHE A 272
GLY A 211
ALA A 212
SER A 215
LEU A 219
 OLC  A 507 (-4.8A)
None
None
None
None
 0.98A 3hs6B-5y79A:
undetectable		 3hs6B-5y79A:
19.23
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.
5yu1 LYSINE
CYCLODEAMINASE

(Streptomyces
pristinaespiralis) 		no annotation 5 GLY A  51
ILE A  61
GLY A 265
ALA A 261
LEU A  48
 None
None
NA  A 401 (-3.5A)
None
None
 0.84A 3hs6B-5yu1A:
undetectable		 3hs6B-5yu1A:
8.64
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.
6b74 COAGULATION FACTOR
XII

(Homo sapiens) 		no annotation 5 GLY B 197
PHE B  41
TYR B  34
GLY B 140
LEU B 155
 None
SO4  B 305 (-4.0A)
NAG  B 309 ( 3.6A)
None
None
 1.01A 3hs6B-6b74B:
undetectable		 3hs6B-6b74B:
9.04
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.
6byx SHORT ULVAN LYASE

(Alteromonas sp.
LOR) 		no annotation 6 GLY A 494
ILE A 491
PHE A 451
ALA A 465
SER A 449
GLY A 447
 None
 1.40A 3hs6B-6byxA:
undetectable		 3hs6B-6byxA:
10.71
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.
6c0e ISOCITRATE
DEHYDROGENASE

(Legionella
pneumophila) 		no annotation 5 PHE A 414
PHE A 399
GLY A 324
GLY A 360
LEU A 364
 None
 1.00A 3hs6B-6c0eA:
undetectable		 3hs6B-6c0eA:
9.25
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.
6ehc OUTER MEMBRANE
PROTEIN U

(Vibrio cholerae) 		no annotation 5 GLY A 143
GLY A 203
ALA A 202
GLY A 149
LEU A 148
 None
 0.79A 3hs6B-6ehcA:
undetectable		 3hs6B-6ehcA:
9.45
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.
6ej2 BETA-SECRETASE 1

(Homo sapiens) 		no annotation 5 TYR A 599
ASN A 414
ILE A 496
GLY A 586
LEU A 561
 None
 0.99A 3hs6B-6ej2A:
undetectable		 3hs6B-6ej2A:
8.72
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.
6gng -

(-) 		no annotation 5 PHE A 470
GLY A 498
ILE A 494
GLY A 362
ALA A 363
 None
 0.98A 3hs6B-6gngA:
undetectable		 3hs6B-6gngA:
undetectable