SIMILAR PATTERNS OF AMINO ACIDS FOR 1YI4_A_ADNA306_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.
1npe NIDOGEN

(Mus musculus) 		PF00058
(Ldl_recept_b) 		5 ILE A 972
PRO A 993
ASP A 989
LEU A 990
ILE A 986
 None
 1.07A 1yi4A-1npeA:
2.0		 1yi4A-1npeA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzn DNA REPAIR AND
RECOMBINATION
PROTEIN RAD51

(Pyrococcus
furiosus) 		PF08423
(Rad51)
PF14520
(HHH_5) 		5 LEU A 261
ALA A 306
ILE A 133
ASP A 267
LEU A 268
 None
 1.08A 1yi4A-1pznA:
undetectable		 1yi4A-1pznA:
22.64
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.
1qhg ATP-DEPENDENT
HELICASE PCRA

(Geobacillus
stearothermophilus) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		5 LEU A  12
LEU A  41
ARG A  39
LEU A 282
ILE A  29
 None
None
ATP  A 726 (-3.7A)
None
None
 1.07A 1yi4A-1qhgA:
undetectable		 1yi4A-1qhgA:
17.24
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.
1ttu LIN-12 AND GLP-1
TRANSCRIPTIONAL
REGULATOR

(Caenorhabditis
elegans) 		PF01833
(TIG)
PF09270
(BTD)
PF09271
(LAG1-DNAbind) 		5 LEU A 302
ALA A 345
ILE A 217
ASP A 323
LEU A 244
 None
 1.05A 1yi4A-1ttuA:
undetectable		 1yi4A-1ttuA:
20.04
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.
1w5t ORC2

(Aeropyrum
pernix) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 LEU A  39
ALA A  80
LEU A  85
ASP A  50
LEU A  48
 None
 1.11A 1yi4A-1w5tA:
undetectable		 1yi4A-1w5tA:
21.45
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.
1wz0 UBIQUITIN-LIKE
PROTEIN SMT3B

(Homo sapiens) 		PF11976
(Rad60-SLD) 		5 LEU A  83
ILE A  41
ASP A  89
LEU A  27
ILE A  25
 None
 1.07A 1yi4A-1wz0A:
undetectable		 1yi4A-1wz0A:
17.87
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.
1xng NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Helicobacter
pylori) 		PF02540
(NAD_synthase) 		5 LEU A  36
ALA A 168
LEU A 171
PRO A 174
LEU A  74
 ATP  A 303 (-4.2A)
None
None
None
None
 0.84A 1yi4A-1xngA:
undetectable		 1yi4A-1xngA:
19.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2a2a DEATH-ASSOCIATED
PROTEIN KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  19
ALA A  40
ILE A  77
LEU A  93
ILE A 160
 None
GOL  A3001 (-3.5A)
GOL  A3001 (-4.8A)
GOL  A3001 ( 4.5A)
GOL  A3001 ( 3.9A)
 0.84A 1yi4A-2a2aA:
27.4		 1yi4A-2a2aA:
30.37
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.
2bej SEGREGATION PROTEIN

(Thermus
thermophilus) 		PF13614
(AAA_31) 		5 LEU A 131
ALA A  12
LEU A  11
PRO A 120
LEU A  43
 None
 1.11A 1yi4A-2bejA:
undetectable		 1yi4A-2bejA:
21.53
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.
2dcq PUTATIVE PROTEIN
AT4G01050

(Arabidopsis
thaliana) 		no annotation 5 LEU A 120
PRO A  39
ASP A  81
LEU A  80
ILE A 105
 None
 0.92A 1yi4A-2dcqA:
undetectable		 1yi4A-2dcqA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ehd OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Thermus
thermophilus) 		PF00106
(adh_short) 		6 PHE A 114
ALA A 120
ILE A 132
LEU A  82
ASP A 167
LEU A 168
 None
 1.28A 1yi4A-2ehdA:
undetectable		 1yi4A-2ehdA:
19.30
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.
2eke UBIQUITIN-LIKE
PROTEIN SMT3

(Saccharomyces
cerevisiae) 		PF11976
(Rad60-SLD) 		5 LEU C1081
ILE C1039
ASP C1087
LEU C1026
ILE C1024
 None
 0.95A 1yi4A-2ekeC:
undetectable		 1yi4A-2ekeC:
20.18
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.
2f9g MITOGEN-ACTIVATED
PROTEIN KINASE FUS3

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase) 		5 LEU A  19
ALA A  40
ILE A  72
ASP A  99
LEU A 144
 ADP  A 500 (-4.3A)
ADP  A 500 ( 3.7A)
None
ADP  A 500 (-3.5A)
ADP  A 500 (-4.3A)
 1.01A 1yi4A-2f9gA:
15.9		 1yi4A-2f9gA:
26.35
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.
2io1 SMALL
UBIQUITIN-RELATED
MODIFIER 3 PRECURSOR

(Homo sapiens) 		PF11976
(Rad60-SLD) 		5 LEU B  75
ILE B  33
ASP B  81
LEU B  19
ILE B  17
 None
 0.71A 1yi4A-2io1B:
undetectable		 1yi4A-2io1B:
15.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2iwi SERINE/THREONINE-PRO
TEIN KINASE PIM-2

(Homo sapiens) 		PF00069
(Pkinase) 		9 LEU A  38
PHE A  43
ALA A  59
ILE A 100
LEU A 116
PRO A 119
ASP A 124
LEU A 170
ILE A 181
 HB1  A1289 ( 4.1A)
HB1  A1289 (-3.9A)
HB1  A1289 ( 3.7A)
HB1  A1289 (-4.1A)
HB1  A1289 (-3.1A)
HB1  A1289 ( 4.9A)
HB1  A1289 (-3.6A)
HB1  A1289 (-4.7A)
HB1  A1289 (-3.7A)
 0.62A 1yi4A-2iwiA:
25.5		 1yi4A-2iwiA:
54.72
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.
2j3e T7I23.11 PROTEIN

(Arabidopsis
thaliana) 		PF04548
(AIG1) 		5 LEU A 158
ILE A 202
LEU A 155
ASP A 180
LEU A 183
 None
 1.06A 1yi4A-2j3eA:
undetectable		 1yi4A-2j3eA:
24.41
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.
2mgs C-X-C MOTIF
CHEMOKINE 5

(Homo sapiens) 		PF00048
(IL8) 		5 ALA A  46
ILE A  67
LEU A  30
ASP A  57
LEU A  63
 None
 1.13A 1yi4A-2mgsA:
undetectable		 1yi4A-2mgsA:
12.59
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.
2nn6 EXOSOME COMPLEX
EXONUCLEASE RRP43
EXOSOME COMPONENT 6

(Homo sapiens) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 PHE F 105
ALA C 155
ILE C 109
LEU C 156
ASP C  84
 None
 1.09A 1yi4A-2nn6F:
undetectable		 1yi4A-2nn6F:
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.
2nxx ECDYSONE RECEPTOR
(ECR, NRH1)

(Tribolium
castaneum) 		PF00104
(Hormone_recep) 		5 LEU E 391
ALA E 373
LEU E 376
ASP E 386
LEU E 382
 None
 1.10A 1yi4A-2nxxE:
undetectable		 1yi4A-2nxxE:
23.10
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.
2q9r PROTEIN OF UNKNOWN
FUNCTION

(Shewanella
baltica) 		PF04222
(DUF416) 		6 LEU A 160
ILE A 168
LEU A 165
ASP A 185
LEU A 182
ILE A 167
 GOL  A 206 (-4.7A)
None
None
GOL  A 206 (-3.7A)
GOL  A 206 (-4.9A)
GOL  A 206 (-4.9A)
 1.24A 1yi4A-2q9rA:
undetectable		 1yi4A-2q9rA:
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.
2v1w PDZ AND LIM DOMAIN
PROTEIN 4

(Homo sapiens) 		PF00595
(PDZ) 		5 ALA A  38
ILE A  29
LEU A  43
LEU A  17
ILE A  49
 None
 1.12A 1yi4A-2v1wA:
undetectable		 1yi4A-2v1wA:
13.97
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.
2vuw SERINE/THREONINE-PRO
TEIN KINASE HASPIN

(Homo sapiens) 		PF12330
(Haspin_kinase) 		5 ALA A 509
ILE A 557
ASP A 611
LEU A 656
ILE A 686
 5ID  A1800 (-3.4A)
5ID  A1800 ( 4.5A)
5ID  A1800 (-3.6A)
5ID  A1800 (-4.5A)
IOD  A1799 (-4.2A)
 0.72A 1yi4A-2vuwA:
17.2		 1yi4A-2vuwA:
24.72
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.
2w4k DEATH-ASSOCIATED
PROTEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  19
ALA A  40
ILE A  77
LEU A  93
ILE A 160
 ADP  A1303 ( 3.9A)
ADP  A1303 (-3.5A)
ADP  A1303 ( 4.2A)
ADP  A1303 ( 4.1A)
ADP  A1303 ( 4.1A)
 0.70A 1yi4A-2w4kA:
27.3		 1yi4A-2w4kA:
29.70
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.
2w4o CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE IV

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  52
ALA A  73
ILE A 102
LEU A 118
LEU A 171
 DKI  A1338 (-3.8A)
DKI  A1338 ( 3.7A)
DKI  A1338 ( 4.4A)
DKI  A1338 ( 4.7A)
DKI  A1338 (-4.9A)
 0.44A 1yi4A-2w4oA:
22.7		 1yi4A-2w4oA:
28.53
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.
2wsb GALACTITOL
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF13561
(adh_short_C2) 		5 LEU A 232
PHE A  31
ALA A 228
PRO A 189
LEU A 142
 None
None
None
NAD  A 500 (-3.9A)
NAD  A 500 (-3.7A)
 1.09A 1yi4A-2wsbA:
undetectable		 1yi4A-2wsbA:
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.
2x4f MYOSIN LIGHT CHAIN
KINASE FAMILY MEMBER
4

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 112
ALA A 133
ILE A 164
LEU A 234
ILE A 246
 16X  A1374 (-4.1A)
16X  A1374 ( 3.8A)
None
16X  A1374 ( 4.8A)
16X  A1374 (-4.1A)
 0.98A 1yi4A-2x4fA:
26.5		 1yi4A-2x4fA:
24.27
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.
2yab DEATH-ASSOCIATED
PROTEIN KINASE 2

(Mus musculus) 		PF00069
(Pkinase) 		5 LEU A  19
ALA A  40
ILE A  77
LEU A  93
ILE A 160
 AMP  A1302 (-3.7A)
AMP  A1302 (-3.6A)
AMP  A1302 ( 3.8A)
AMP  A1302 ( 3.6A)
AMP  A1302 (-4.0A)
 0.70A 1yi4A-2yabA:
27.3		 1yi4A-2yabA:
28.13
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.
2yr5 PRO-ENZYME OF
L-PHENYLALANINE
OXIDASE

(Pseudomonas sp.
P-501) 		no annotation 5 LEU A 669
ALA A 691
PRO A  48
LEU A  78
ILE A 676
 None
 1.13A 1yi4A-2yr5A:
undetectable		 1yi4A-2yr5A:
16.81
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.
2z7r RIBOSOMAL PROTEIN S6
KINASE ALPHA-1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  68
ALA A  92
LEU A 141
ASP A 148
LEU A 194
 STU  A   1 (-3.8A)
STU  A   1 (-3.3A)
STU  A   1 ( 4.6A)
STU  A   1 (-3.8A)
STU  A   1 (-4.6A)
 0.43A 1yi4A-2z7rA:
27.1		 1yi4A-2z7rA:
27.41
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.
2zmc DUAL SPECIFICITY
PROTEIN KINASE TTK

(Homo sapiens) 		PF00069
(Pkinase) 		5 ALA A 551
ILE A 586
ASP A 608
LEU A 654
ILE A 663
 None
None
None
None
7PE  A   1 (-4.7A)
 0.98A 1yi4A-2zmcA:
23.2		 1yi4A-2zmcA:
25.19
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.
2zsk 226AA LONG
HYPOTHETICAL
ASPARTATE RACEMASE

(Pyrococcus
horikoshii) 		PF01177
(Asp_Glu_race) 		5 LEU A 191
ALA A 199
ILE A 157
LEU A 154
ILE A 158
 None
 1.11A 1yi4A-2zskA:
undetectable		 1yi4A-2zskA:
20.42
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.
3a1t IRON(II) TRANSPORT
PROTEIN B

(Thermotoga
maritima) 		PF02421
(FeoB_N) 		5 LEU A  90
ALA A  22
LEU A  21
PRO A  71
ILE A  68
 None
 1.05A 1yi4A-3a1tA:
undetectable		 1yi4A-3a1tA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis) 		PF00294
(PfkB) 		5 ALA A  56
ILE A   5
LEU A  57
ASP A 166
ILE A 140
 None
None
None
MG  A 503 ( 4.3A)
None
 1.06A 1yi4A-3b1rA:
undetectable		 1yi4A-3b1rA:
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.
3bh0 DNAB-LIKE
REPLICATIVE HELICASE

(Bacillus phage
SPP1) 		PF03796
(DnaB_C) 		5 LEU A 213
ALA A 216
ILE A 352
LEU A 354
ILE A 200
 None
 1.12A 1yi4A-3bh0A:
undetectable		 1yi4A-3bh0A:
22.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bqr DEATH-ASSOCIATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  19
ALA A  40
ILE A  77
LEU A  93
ILE A 160
 4RB  A 401 ( 3.9A)
4RB  A 401 (-3.3A)
4RB  A 401 ( 4.3A)
4RB  A 401 ( 4.1A)
4RB  A 401 (-3.5A)
 0.80A 1yi4A-3bqrA:
26.1		 1yi4A-3bqrA:
30.10
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 LEU A  46
PHE A   2
ALA A  34
ILE A 176
LEU A  35
 None
 1.13A 1yi4A-3da1A:
undetectable		 1yi4A-3da1A:
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 LEU A 145
PHE A 103
ILE A  88
LEU A  59
LEU A 107
ILE A 169
 None
 1.38A 1yi4A-3dljA:
undetectable		 1yi4A-3dljA:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f2a PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1

(Homo sapiens) 		PF00069
(Pkinase) 		9 LEU A  44
PHE A  49
ALA A  65
ILE A 104
LEU A 120
ARG A 122
ASP A 128
LEU A 174
ILE A 185
 985  A   1 (-4.1A)
985  A   1 (-4.0A)
985  A   1 (-3.5A)
985  A   1 ( 4.7A)
985  A   1 (-4.3A)
None
985  A   1 (-4.7A)
985  A   1 (-4.8A)
985  A   1 (-3.7A)
 0.78A 1yi4A-3f2aA:
44.6		 1yi4A-3f2aA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f2a PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1

(Homo sapiens) 		PF00069
(Pkinase) 		9 LEU A  44
PHE A  49
ALA A  65
LEU A 120
ARG A 122
PRO A 123
ASP A 128
LEU A 174
ILE A 185
 985  A   1 (-4.1A)
985  A   1 (-4.0A)
985  A   1 (-3.5A)
985  A   1 (-4.3A)
None
None
985  A   1 (-4.7A)
985  A   1 (-4.8A)
985  A   1 (-3.7A)
 0.51A 1yi4A-3f2aA:
44.6		 1yi4A-3f2aA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fbs OXIDOREDUCTASE

(Agrobacterium
fabrum) 		PF07992
(Pyr_redox_2) 		5 ILE A  28
LEU A  21
ASP A  32
LEU A  30
ILE A   7
 None
None
FAD  A 298 (-3.0A)
None
None
 1.09A 1yi4A-3fbsA:
undetectable		 1yi4A-3fbsA:
20.19
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.
3g5o UNCHARACTERIZED
PROTEIN RV2865
UNCHARACTERIZED
PROTEIN RV2866

(Mycobacterium
tuberculosis) 		PF02604
(PhdYeFM_antitox)
PF05016
(ParE_toxin) 		5 LEU B  77
ALA B  45
ILE A  89
ASP B  29
LEU B  30
 None
 0.95A 1yi4A-3g5oB:
undetectable		 1yi4A-3g5oB:
14.65
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.
3gbz KINASE, CMGC CDK

(Giardia
intestinalis) 		PF00069
(Pkinase) 		5 LEU A  21
ALA A  42
ILE A  75
ASP A  97
LEU A 143
 None
 0.96A 1yi4A-3gbzA:
23.0		 1yi4A-3gbzA:
25.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hhd FATTY ACID SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 345
ALA A 244
ILE A 246
LEU A 168
ILE A 402
 None
 1.04A 1yi4A-3hhdA:
undetectable		 1yi4A-3hhdA:
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.
3i6u SERINE/THREONINE-PRO
TEIN KINASE CHK2

(Homo sapiens) 		PF00069
(Pkinase)
PF00498
(FHA) 		5 LEU A 226
ALA A 247
ILE A 286
LEU A 301
LEU A 354
 None
 0.65A 1yi4A-3i6uA:
25.8		 1yi4A-3i6uA:
24.59
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.
3ipl 2-SUCCINYLBENZOATE--
COA LIGASE

(Staphylococcus
aureus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A  41
ALA A  65
ILE A  63
LEU A  51
ILE A  73
 None
 1.10A 1yi4A-3iplA:
undetectable		 1yi4A-3iplA:
20.35
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.
3lm5 SERINE/THREONINE-PRO
TEIN KINASE 17B

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  39
ALA A  60
ILE A  94
LEU A 110
LEU A 165
 QUE  A   1 ( 3.8A)
QUE  A   1 (-3.2A)
QUE  A   1 (-4.6A)
QUE  A   1 (-4.1A)
None
 0.63A 1yi4A-3lm5A:
26.7		 1yi4A-3lm5A:
24.85
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.
3mdy BONE MORPHOGENETIC
PROTEIN RECEPTOR
TYPE-1B

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF08515
(TGF_beta_GS) 		5 ALA A 354
LEU A 351
ARG A 331
LEU A 333
ILE A 348
 None
 1.10A 1yi4A-3mdyA:
23.0		 1yi4A-3mdyA:
25.60
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.
3nyo G PROTEIN-COUPLED
RECEPTOR KINASE 6

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 LEU A 192
ALA A 213
LEU A 263
ASP A 270
LEU A 318
 AMP  A 577 ( 4.3A)
AMP  A 577 (-3.4A)
AMP  A 577 ( 4.7A)
AMP  A 577 (-3.6A)
AMP  A 577 (-4.8A)
 0.77A 1yi4A-3nyoA:
27.8		 1yi4A-3nyoA:
18.27
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.
3qvl PUTATIVE HYDANTOIN
RACEMASE

(Klebsiella
pneumoniae) 		PF01177
(Asp_Glu_race) 		5 LEU A  61
ALA A  88
ILE A  77
PRO A  83
ILE A   9
 None
 1.10A 1yi4A-3qvlA:
undetectable		 1yi4A-3qvlA:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3txo PROTEIN KINASE C ETA
TYPE

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 LEU A 361
PHE A 366
ALA A 382
ASP A 440
LEU A 486
 07U  A   1 ( 4.8A)
07U  A   1 (-3.7A)
07U  A   1 (-3.3A)
07U  A   1 (-3.9A)
07U  A   1 (-4.3A)
 0.51A 1yi4A-3txoA:
20.3		 1yi4A-3txoA:
27.45
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.
3v2g 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 PHE A 145
ALA A 151
ILE A 161
LEU A 113
LEU A 198
 None
 1.09A 1yi4A-3v2gA:
undetectable		 1yi4A-3v2gA:
20.27
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.
3v2g 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 PHE A 145
ALA A 151
LEU A 113
ASP A 197
LEU A 198
 None
 1.02A 1yi4A-3v2gA:
undetectable		 1yi4A-3v2gA:
20.27
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.
3v62 UBIQUITIN-LIKE
PROTEIN SMT3

(Saccharomyces
cerevisiae) 		PF11976
(Rad60-SLD) 		5 LEU A  81
ILE A  39
ASP A  87
LEU A  26
ILE A  24
 None
MLY  A  40 ( 3.6A)
None
MLY  A  27 ( 4.0A)
MLY  A  41 ( 4.2A)
 0.81A 1yi4A-3v62A:
undetectable		 1yi4A-3v62A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ay7 METHYLCOBALAMIN:
COENZYME M
METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF01208
(URO-D) 		5 LEU A  81
ALA A 185
ILE A 181
ASP A 157
LEU A 158
 None
 1.10A 1yi4A-4ay7A:
undetectable		 1yi4A-4ay7A:
22.28
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.
4b99 MITOGEN-ACTIVATED
PROTEIN KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 ALA A  82
ILE A 115
LEU A 137
ASP A 143
LEU A 189
 R4L  A1394 ( 3.7A)
R4L  A1394 (-4.9A)
R4L  A1394 (-3.9A)
R4L  A1394 ( 4.2A)
R4L  A1394 (-4.5A)
 0.88A 1yi4A-4b99A:
22.7		 1yi4A-4b99A:
24.68
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.
4bkg SMALL
UBIQUITIN-RELATED
MODIFIER 2

(Homo sapiens) 		PF11976
(Rad60-SLD) 		5 LEU A  76
ILE A  34
ASP A  82
LEU A  20
ILE A  18
 None
 0.98A 1yi4A-4bkgA:
undetectable		 1yi4A-4bkgA:
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.
4c0t LIKELY PROTEIN
KINASE

(Candida
albicans) 		PF00069
(Pkinase) 		5 LEU A 246
ALA A 267
ILE A 302
LEU A 318
LEU A 371
 None
 0.53A 1yi4A-4c0tA:
28.0		 1yi4A-4c0tA:
13.34
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.
4ckr EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 LEU A 616
ALA A 653
ILE A 685
ASP A 708
LEU A 773
 None
DI1  A1000 (-3.6A)
DI1  A1000 (-4.5A)
None
DI1  A1000 (-4.5A)
 0.88A 1yi4A-4ckrA:
20.8		 1yi4A-4ckrA:
26.69
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.
4fod ALK TYROSINE KINASE
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 LEU A1122
ALA A1148
LEU A1196
ASP A1203
LEU A1256
 0UV  A1501 (-3.8A)
0UV  A1501 (-3.4A)
0UV  A1501 (-3.7A)
0UV  A1501 ( 4.6A)
0UV  A1501 (-4.6A)
 0.59A 1yi4A-4fodA:
21.6		 1yi4A-4fodA:
25.07
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.
4gf2 ERYTHROCYTE BINDING
ANTIGEN 140

(Plasmodium
falciparum) 		PF05424
(Duffy_binding) 		5 LEU A 405
PHE A 327
ILE A 320
LEU A 376
LEU A 396
 None
 0.86A 1yi4A-4gf2A:
undetectable		 1yi4A-4gf2A:
18.07
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.
4gzi GLUCAN
ENDO-1,3-BETA-D-GLUC
OSIDASE

(Solanum
tuberosum) 		PF00332
(Glyco_hydro_17) 		5 LEU A 163
ALA A 244
ILE A 186
LEU A 248
ILE A 182
 None
 1.00A 1yi4A-4gziA:
undetectable		 1yi4A-4gziA:
20.29
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.
4imp POLYKETIDE SYNTHASE
EXTENDER MODULES 3-4

(Saccharopolyspora
spinosa) 		PF08659
(KR) 		5 LEU A 489
PHE A 410
ALA A 406
PRO A 280
LEU A 301
 None
 1.04A 1yi4A-4impA:
undetectable		 1yi4A-4impA:
19.97
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.
4ixa RESPONSE REGULATOR
SAER

(Staphylococcus
epidermidis) 		PF00486
(Trans_reg_C) 		5 LEU A 138
ALA A 166
ILE A 215
LEU A 165
ILE A 201
 None
 1.14A 1yi4A-4ixaA:
undetectable		 1yi4A-4ixaA:
16.73
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.
4jvs PUTATIVE
UNCHARACTERIZED
PROTEIN

(Legionella
drancourtii) 		no annotation 5 LEU A 594
ALA A 561
ILE A 580
LEU A 560
LEU A 581
 None
 1.12A 1yi4A-4jvsA:
undetectable		 1yi4A-4jvsA:
22.36
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.
4npn SMALL
UBIQUITIN-RELATED
MODIFIER 2

(Homo sapiens) 		PF11976
(Rad60-SLD) 		5 LEU A  76
ILE A  34
ASP A  82
LEU A  20
ILE A  18
 None
 1.01A 1yi4A-4npnA:
undetectable		 1yi4A-4npnA:
13.97
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.
4oko RAPID ENCYSTMENT
PHENOTYPE PROTEIN 34
KDA

(Francisella
tularensis) 		PF00246
(Peptidase_M14) 		5 ALA A 100
ILE A  40
PRO A 117
ASP A  50
ILE A  49
 None
 1.11A 1yi4A-4okoA:
undetectable		 1yi4A-4okoA:
21.30
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.
4ozr ECDYSONE RECEPTOR

(Pediculus
humanus) 		PF00104
(Hormone_recep) 		5 LEU E 364
ALA E 346
LEU E 349
ASP E 359
LEU E 355
 None
 1.07A 1yi4A-4ozrE:
undetectable		 1yi4A-4ozrE:
21.45
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.
4ozt ECDYSONE RECEPTOR

(Pediculus
humanus) 		PF00104
(Hormone_recep) 		5 LEU E 364
ALA E 346
LEU E 349
ASP E 359
LEU E 355
 None
 1.10A 1yi4A-4oztE:
undetectable		 1yi4A-4oztE:
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.
4q9z HUMAN PROTEIN KINASE
C THETA

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		5 LEU A 386
PHE A 391
ALA A 407
ASP A 465
LEU A 511
 PZW  A 801 (-3.9A)
PZW  A 801 (-3.7A)
PZW  A 801 (-3.5A)
None
PZW  A 801 (-4.8A)
 0.46A 1yi4A-4q9zA:
28.2		 1yi4A-4q9zA:
25.22
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.
4quk DIHYDROFLAVONOL-4-RE
DUCTASE

(Medicago
truncatula) 		PF01370
(Epimerase) 		5 ALA A 172
ILE A 102
LEU A 171
PRO A 104
LEU A 101
 None
 1.04A 1yi4A-4qukA:
undetectable		 1yi4A-4qukA:
19.50
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.
4rk2 PUTATIVE SUGAR ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Rhizobium etli) 		PF01547
(SBP_bac_1) 		5 LEU A  51
PHE A  64
LEU A  39
LEU A 311
ILE A  91
 None
 1.10A 1yi4A-4rk2A:
undetectable		 1yi4A-4rk2A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rkr TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Arthrobacter
sp. FB24) 		PF13377
(Peripla_BP_3) 		6 LEU A 331
ALA A 307
ILE A 150
LEU A 311
ASP A 153
LEU A 152
 None
None
None
None
LBT  A 401 (-3.0A)
None
 1.15A 1yi4A-4rkrA:
undetectable		 1yi4A-4rkrA:
23.46
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.
4tnb G PROTEIN-COUPLED
RECEPTOR KINASE 5

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 LEU A 192
ALA A 213
LEU A 263
ASP A 270
LEU A 318
 SGV  A 601 (-4.1A)
SGV  A 601 (-3.3A)
SGV  A 601 (-4.5A)
SGV  A 601 (-4.2A)
SGV  A 601 (-4.9A)
 0.77A 1yi4A-4tnbA:
23.6		 1yi4A-4tnbA:
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.
4u88 TRANSCRIPTIONAL
REGULATOR SAER

(Staphylococcus
aureus) 		PF00486
(Trans_reg_C) 		5 LEU A  90
ALA A 118
ILE A 167
LEU A 117
ILE A 153
 None
 1.10A 1yi4A-4u88A:
undetectable		 1yi4A-4u88A:
18.25
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.
4wui N-(5'-PHOSPHORIBOSYL
)ANTHRANILATE
ISOMERASE

(Jonesia
denitrificans) 		PF00697
(PRAI) 		5 LEU A  68
ALA A  71
LEU A  57
ASP A  89
LEU A  81
 None
 1.01A 1yi4A-4wuiA:
undetectable		 1yi4A-4wuiA:
19.93
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.
4x82 ZINC TRANSPORTER
ZIP4

(Pteropus alecto) 		no annotation 5 LEU B 176
ALA B  93
ILE B 139
LEU B  96
LEU B 136
 None
 1.01A 1yi4A-4x82B:
undetectable		 1yi4A-4x82B:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yhj G PROTEIN-COUPLED
RECEPTOR KINASE 4

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 LEU A 193
ALA A 214
LEU A 264
ASP A 271
LEU A 319
 AN2  A 601 ( 4.2A)
AN2  A 601 (-3.6A)
AN2  A 601 ( 4.8A)
None
None
 0.66A 1yi4A-4yhjA:
25.1		 1yi4A-4yhjA:
19.49
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.
4zm6 N-ACETYL-BETA-D
GLUCOSAMINIDASE

(Rhizomucor
miehei) 		PF00583
(Acetyltransf_1)
PF00933
(Glyco_hydro_3) 		5 LEU A 163
LEU A 217
PRO A 212
LEU A 135
ILE A 178
 None
 1.10A 1yi4A-4zm6A:
undetectable		 1yi4A-4zm6A:
15.72
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.
4zsl MITOGEN-ACTIVATED
PROTEIN KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 ALA A  82
ILE A 115
LEU A 137
ASP A 143
LEU A 189
 None
 0.91A 1yi4A-4zslA:
22.4		 1yi4A-4zslA:
26.22
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.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 353
ALA A 335
LEU A 338
ASP A 348
LEU A 344
 SO4  A 602 ( 4.9A)
None
None
None
None
 1.08A 1yi4A-5c4tA:
undetectable		 1yi4A-5c4tA:
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.
5c98 AGAP007691-PB

(Anopheles
gambiae) 		PF00079
(Serpin) 		5 LEU A 251
PHE A 357
LEU A 227
ASP A 237
LEU A 278
 None
 1.13A 1yi4A-5c98A:
undetectable		 1yi4A-5c98A:
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.
5d6j UBIQUITIN-LIKE
PROTEIN SMT3

(Saccharomyces
cerevisiae) 		PF11976
(Rad60-SLD) 		5 LEU B  81
ILE B  39
ASP B  87
LEU B  26
ILE B  24
 None
 1.06A 1yi4A-5d6jB:
undetectable		 1yi4A-5d6jB:
14.02
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.
5de0 DEFERROCHELATASE

(Vibrio cholerae) 		PF04261
(Dyp_perox) 		5 ALA A  33
ILE A 115
ASP A  94
LEU A  21
ILE A 122
 None
 0.94A 1yi4A-5de0A:
undetectable		 1yi4A-5de0A:
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.
5e3c DIPEPTIDYL PEPTIDASE
3

(Homo sapiens) 		PF03571
(Peptidase_M49) 		5 LEU A  63
ALA A  96
LEU A  93
PRO A 116
LEU A 123
 None
 1.11A 1yi4A-5e3cA:
undetectable		 1yi4A-5e3cA:
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.
5fm2 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 LEU A 730
PHE A 735
ALA A 756
ILE A 788
LEU A 881
 PP1  A2012 (-4.6A)
PP1  A2012 (-4.0A)
PP1  A2012 (-3.2A)
None
PP1  A2012 (-4.6A)
 0.99A 1yi4A-5fm2A:
24.5		 1yi4A-5fm2A:
23.56
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.
5gs0 TOLL-LIKE RECEPTOR 3

(Homo sapiens) 		PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 128
ILE A 138
PRO A 142
LEU A 114
ILE A 135
 None
 1.06A 1yi4A-5gs0A:
undetectable		 1yi4A-5gs0A:
17.13
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.
5gtm INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		5 LEU A 214
ILE A 202
LEU A 179
ASP A 236
ILE A 206
 None
 1.09A 1yi4A-5gtmA:
undetectable		 1yi4A-5gtmA:
20.20
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.
5ip7 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB3

(Saccharomyces
cerevisiae) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		5 LEU C 147
ILE C  63
LEU C  58
ASP C 117
ILE C 144
 None
 1.11A 1yi4A-5ip7C:
undetectable		 1yi4A-5ip7C:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jne E3 SUMO-PROTEIN
LIGASE
SIZ1,UBIQUITIN-LIKE
PROTEIN SMT3

(Saccharomyces
cerevisiae) 		PF02891
(zf-MIZ)
PF11976
(Rad60-SLD)
PF14324
(PINIT) 		5 LEU A 514
ILE A 472
ASP A 520
LEU A 459
ILE A 457
 None
 0.84A 1yi4A-5jneA:
undetectable		 1yi4A-5jneA:
20.75
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.
5jp1 SMALL
UBIQUITIN-RELATED
MODIFIER

(Solanum
lycopersicum) 		PF11976
(Rad60-SLD) 		5 LEU B  79
ILE B  37
ASP B  85
LEU B  23
ILE B  21
 None
 0.70A 1yi4A-5jp1B:
undetectable		 1yi4A-5jp1B:
17.10
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.
5tr0 SEED LINOLEATE
13S-LIPOXYGENASE-1

(Glycine max) 		no annotation 5 LEU A 675
ILE A 683
LEU A 680
LEU A 528
ILE A 682
 None
 0.98A 1yi4A-5tr0A:
undetectable		 1yi4A-5tr0A:
16.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tur SERINE/THREONINE-PRO
TEIN KINASE PIM-1

(Homo sapiens) 		no annotation 10 LEU A  44
PHE A  49
ALA A  65
ILE A 104
LEU A 120
ARG A 122
PRO A 123
ASP A 128
LEU A 174
ILE A 185
 None
7LK  A 401 ( 4.4A)
7LK  A 401 (-3.3A)
7LK  A 401 (-4.8A)
7LK  A 401 (-4.0A)
None
None
7LK  A 401 ( 3.9A)
7LK  A 401 (-4.8A)
7LK  A 401 ( 4.3A)
 0.62A 1yi4A-5turA:
44.3		 1yi4A-5turA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uj7 ORIGIN RECOGNITION
COMPLEX SUBUNIT 4

(Homo sapiens) 		PF13191
(AAA_16)
PF14629
(ORC4_C) 		5 LEU C 173
ALA C 165
ILE C 198
LEU C 201
LEU C  64
 None
 1.11A 1yi4A-5uj7C:
undetectable		 1yi4A-5uj7C:
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.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 LEU A 562
ALA A 647
ASP A 569
LEU A 573
ILE A 592
 None
 1.06A 1yi4A-5ur2A:
undetectable		 1yi4A-5ur2A:
13.35
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.
5v8t UBIQUITIN-LIKE
PROTEIN
SMT3,PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei;
Saccharomyces
cerevisiae) 		no annotation 5 LEU A -17
ILE A -59
ASP A -11
LEU A -72
ILE A -74
 None
 0.75A 1yi4A-5v8tA:
undetectable		 1yi4A-5v8tA:
15.44
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.
5wva SHORT-CHAIN
DEHYDROGENASE

(Serratia
marcescens) 		no annotation 5 PHE A 123
ALA A 129
LEU A  91
ASP A 175
LEU A 176
 None
 1.08A 1yi4A-5wvaA:
undetectable		 1yi4A-5wvaA:
11.36
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.
5y86 DUAL SPECIFICITY
TYROSINE-PHOSPHORYLA
TION-REGULATED
KINASE 3

(Homo sapiens) 		no annotation 6 PHE A 220
ALA A 236
ILE A 272
ASP A 294
LEU A 342
ILE A 354
 HRM  A 601 ( 4.1A)
HRM  A 601 (-3.5A)
HRM  A 601 ( 4.8A)
None
None
HRM  A 601 (-3.7A)
 0.84A 1yi4A-5y86A:
24.7		 1yi4A-5y86A:
12.45
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.
6b4w DUAL SPECIFICITY
PROTEIN KINASE TTK

(Homo sapiens) 		no annotation 5 ALA A 551
ILE A 586
ASP A 608
LEU A 654
ILE A 663
 CQ7  A 801 (-3.2A)
CQ7  A 801 ( 4.5A)
CQ7  A 801 (-4.7A)
CQ7  A 801 (-4.5A)
CQ7  A 801 (-3.7A)
 0.84A 1yi4A-6b4wA:
22.8		 1yi4A-6b4wA:
28.43
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.
6cwo RIBONUCLEOTIDE
REDUCTASE

(Flavobacterium
johnsoniae) 		no annotation 5 PHE A 177
ILE A 170
ASP A 256
LEU A 257
ILE A 252
 None
 1.14A 1yi4A-6cwoA:
undetectable		 1yi4A-6cwoA:
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.
6cwp RIBONUCLEOTIDE
REDUCTASE

(Flavobacterium
johnsoniae) 		no annotation 5 PHE A 177
ILE A 170
ASP A 256
LEU A 257
ILE A 252
 None
 1.11A 1yi4A-6cwpA:
undetectable		 1yi4A-6cwpA:
16.53