SIMILAR PATTERNS OF AMINO ACIDS FOR 3SP9_B_IL2B901

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.
1e51 DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Homo sapiens) 		PF00490
(ALAD) 		5 LEU A  61
PHE A  79
ILE A 314
LEU A  73
TYR A 196
 None
 1.15A 3sp9B-1e51A:
0.0		 3sp9B-1e51A:
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.
1fiz BETA-ACROSIN HEAVY
CHAIN

(Sus scrofa) 		PF00089
(Trypsin) 		5 THR A 231
HIS A  91
ILE A 103
LEU A  47
VAL A 250
 None
 1.26A 3sp9B-1fizA:
undetectable		 3sp9B-1fizA:
23.20
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.
1foh PHENOL HYDROXYLASE

(Cutaneotrichosporon
cutaneum) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		5 VAL A 617
ILE A 528
LEU A 535
VAL A 541
TYR A 603
 None
 1.24A 3sp9B-1fohA:
0.0		 3sp9B-1fohA:
17.92
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.
1gzg DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Pseudomonas
aeruginosa) 		PF00490
(ALAD) 		5 LEU A 266
PHE A 281
THR A 323
ILE A  80
LEU A  33
 None
 1.16A 3sp9B-1gzgA:
undetectable		 3sp9B-1gzgA:
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.
1hg3 TRIOSEPHOSPHATE
ISOMERASE

(Pyrococcus
woesei) 		PF00121
(TIM)
PF05690
(ThiG) 		5 THR A 120
THR A  92
ILE A  67
LEU A 106
VAL A 133
 None
 1.21A 3sp9B-1hg3A:
0.0		 3sp9B-1hg3A:
22.65
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.
1hrd GLUTAMATE
DEHYDROGENASE

([Clostridium]
symbiosum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 LEU A 228
VAL A 217
THR A 209
LEU A 235
VAL A 233
 None
 1.04A 3sp9B-1hrdA:
0.0		 3sp9B-1hrdA:
20.09
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.
1htr GASTRICSIN

(Homo sapiens) 		PF00026
(Asp) 		5 LEU B 278
VAL B 307
PHE B 308
THR B 261
LEU B 233
 None
 1.21A 3sp9B-1htrB:
undetectable		 3sp9B-1htrB:
19.00
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.
1ikt ESTRADIOL 17
BETA-DEHYDROGENASE 4

(Homo sapiens) 		PF02036
(SCP2) 		5 THR A  70
THR A  71
HIS A  37
LEU A 110
VAL A  30
 None
None
None
OXN  A 123 ( 4.9A)
None
 1.17A 3sp9B-1iktA:
0.0		 3sp9B-1iktA:
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.
1lox 15-LIPOXYGENASE

(Oryctolagus
cuniculus) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 VAL A 101
CYH A  78
THR A  10
LEU A  39
VAL A  22
 None
 1.23A 3sp9B-1loxA:
undetectable		 3sp9B-1loxA:
18.49
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.
1lvl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 VAL A 126
THR A   6
THR A   7
ILE A  29
VAL A  34
 None
None
None
None
FAD  A 459 ( 4.9A)
 1.19A 3sp9B-1lvlA:
undetectable		 3sp9B-1lvlA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ogk DEOXYURIDINE
TRIPHOSPHATASE

(Trypanosoma
cruzi) 		PF08761
(dUTPase_2) 		5 VAL A  10
THR A 176
ILE A 163
LEU A 190
VAL A 191
 None
 1.28A 3sp9B-1ogkA:
undetectable		 3sp9B-1ogkA:
21.23
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.
1osn THYMIDINE KINASE

(Human
alphaherpesvirus
3) 		PF00693
(Herpes_TK) 		5 LEU A 239
VAL A 205
THR A 212
LEU A 261
VAL A 260
 None
 1.14A 3sp9B-1osnA:
undetectable		 3sp9B-1osnA:
21.29
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.
1qz9 KYNURENINASE

(Pseudomonas
fluorescens) 		PF00266
(Aminotran_5) 		5 LEU A 332
VAL A 345
ILE A 360
LEU A 395
VAL A 321
 None
 1.16A 3sp9B-1qz9A:
undetectable		 3sp9B-1qz9A:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u08 HYPOTHETICAL
AMINOTRANSFERASE
YBDL

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 LEU A 169
VAL A 199
PHE A 198
LEU A 219
VAL A 218
 None
 1.28A 3sp9B-1u08A:
undetectable		 3sp9B-1u08A:
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.
1ue8 367AA LONG
HYPOTHETICAL
CYTOCHROME P450

(Sulfurisphaera
tokodaii) 		PF00067
(p450) 		5 VAL A 126
THR A 216
ILE A 115
LEU A 104
VAL A 100
 None
 1.23A 3sp9B-1ue8A:
undetectable		 3sp9B-1ue8A:
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.
1vlu GAMMA-GLUTAMYL
PHOSPHATE REDUCTASE

(Saccharomyces
cerevisiae) 		PF00171
(Aldedh) 		5 LEU A 223
VAL A 413
ILE A  33
LEU A 145
VAL A 120
 None
 0.96A 3sp9B-1vluA:
undetectable		 3sp9B-1vluA:
20.91
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.
1vqt OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Thermotoga
maritima) 		PF00215
(OMPdecase) 		5 LEU A 105
PHE A  55
ILE A  49
LEU A 148
VAL A 130
 None
None
None
EDO  A 204 (-4.9A)
EDO  A 204 ( 4.9A)
 1.16A 3sp9B-1vqtA:
undetectable		 3sp9B-1vqtA:
23.51
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.
1xb2 ELONGATION FACTOR
TS, MITOCHONDRIAL

(Bos taurus) 		PF00889
(EF_TS) 		5 LEU B 297
CYH B 253
THR B 255
LEU B 265
VAL B 313
 None
 1.29A 3sp9B-1xb2B:
undetectable		 3sp9B-1xb2B:
21.86
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.
1xb2 ELONGATION FACTOR
TS, MITOCHONDRIAL

(Bos taurus) 		PF00889
(EF_TS) 		5 LEU B 297
VAL B 320
CYH B 253
THR B 255
LEU B 265
 None
 1.16A 3sp9B-1xb2B:
undetectable		 3sp9B-1xb2B:
21.86
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.
2b81 LUCIFERASE-LIKE
MONOOXYGENASE

(Bacillus cereus) 		PF00296
(Bac_luciferase) 		5 LEU A 306
VAL A  26
PHE A 292
LEU A  88
VAL A  47
 None
 1.29A 3sp9B-2b81A:
undetectable		 3sp9B-2b81A:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c41 DPS FAMILY
DNA-BINDING STRESS
RESPONSE PROTEIN

(Thermosynechococcus
elongatus) 		PF00210
(Ferritin) 		5 HIS A 106
ILE A 109
LEU A 131
HIS A 142
TYR A  29
 None
 1.29A 3sp9B-2c41A:
undetectable		 3sp9B-2c41A:
19.37
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.
2ca4 SULFITE:CYTOCHROME C
OXIDOREDUCTASE
SUBUNIT A

(Starkeya
novella) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer) 		5 LEU A  89
THR A 153
ILE A 223
LEU A 140
VAL A 139
 None
 1.18A 3sp9B-2ca4A:
undetectable		 3sp9B-2ca4A:
20.59
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.
2d7s RNA-DEPENDENT RNA
POLYMERASE

(Foot-and-mouth
disease virus) 		PF00680
(RdRP_1) 		5 LEU A  85
PHE A 257
THR A 192
HIS A 188
ILE A 189
 None
 1.27A 3sp9B-2d7sA:
undetectable		 3sp9B-2d7sA:
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.
2gno DNA POLYMERASE III,
GAMMA
SUBUNIT-RELATED
PROTEIN

(Thermotoga
maritima) 		PF13177
(DNA_pol3_delta2) 		5 LEU A 202
VAL A 206
THR A 256
ILE A 280
VAL A 239
 None
 1.15A 3sp9B-2gnoA:
undetectable		 3sp9B-2gnoA:
22.49
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.
2gnp TRANSCRIPTIONAL
REGULATOR

(Streptococcus
pneumoniae) 		PF04198
(Sugar-bind) 		5 LEU A 157
VAL A 125
ILE A  80
LEU A 277
VAL A 207
 None
 1.18A 3sp9B-2gnpA:
undetectable		 3sp9B-2gnpA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gvk HEME PEROXIDASE

(Bacteroides
thetaiotaomicron) 		PF04261
(Dyp_perox) 		5 LEU A 314
PHE A 303
LEU A 131
VAL A  41
TYR A 261
 None
 1.25A 3sp9B-2gvkA:
undetectable		 3sp9B-2gvkA:
21.13
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.
2hig 6-PHOSPHO-1-FRUCTOKI
NASE

(Trypanosoma
brucei) 		PF00365
(PFK) 		5 LEU A 353
CYH A 319
LEU A 361
VAL A 357
HIS A 315
 None
 1.25A 3sp9B-2higA:
undetectable		 3sp9B-2higA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lvv FLAGELLAR
CALCIUM-BINDING
PROTEIN TB-24

(Trypanosoma
brucei) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		5 LEU A  68
VAL A  73
CYH A  77
ILE A  37
LEU A 126
 None
 1.28A 3sp9B-2lvvA:
undetectable		 3sp9B-2lvvA:
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.
2nsm CARBOXYPEPTIDASE N
CATALYTIC CHAIN

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		5 LEU A 359
VAL A 190
PHE A 189
THR A 101
TYR A  29
 None
 1.20A 3sp9B-2nsmA:
undetectable		 3sp9B-2nsmA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2odo ALANINE RACEMASE

(Pseudomonas
fluorescens) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 LEU A 295
VAL A 286
PHE A 287
THR A 234
VAL A 268
 None
 1.28A 3sp9B-2odoA:
undetectable		 3sp9B-2odoA:
21.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A 247
PHE A 273
CYH A 276
THR A 279
ILE A 317
HIS A 440
TYR A 464
 None
735  A 469 (-3.7A)
735  A 469 (-2.9A)
735  A 469 (-3.6A)
735  A 469 ( 4.8A)
735  A 469 (-4.0A)
735  A 469 (-4.6A)
 1.31A 3sp9B-2p54A:
37.7		 3sp9B-2p54A:
70.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p54 PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A 258
PHE A 273
CYH A 276
THR A 279
ILE A 317
HIS A 440
TYR A 464
 None
735  A 469 (-3.7A)
735  A 469 (-2.9A)
735  A 469 (-3.6A)
735  A 469 ( 4.8A)
735  A 469 (-4.0A)
735  A 469 (-4.6A)
 1.29A 3sp9B-2p54A:
37.7		 3sp9B-2p54A:
70.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pk3 GDP-6-DEOXY-D-LYXO-4
-HEXULOSE REDUCTASE

(Aneurinibacillus
thermoaerophilus) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A  97
THR A 165
THR A 167
HIS A 170
ILE A 217
 None
None
None
A2R  A 401 ( 3.9A)
None
 1.27A 3sp9B-2pk3A:
undetectable		 3sp9B-2pk3A:
26.63
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.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE

(Medicago
truncatula) 		PF00201
(UDPGT) 		5 LEU A  32
VAL A 123
THR A 228
THR A 227
ILE A 249
 None
 1.30A 3sp9B-2pq6A:
undetectable		 3sp9B-2pq6A:
21.60
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.
2qt3 N-ISOPROPYLAMMELIDE
ISOPROPYL
AMIDOHYDROLASE

(Pseudomonas sp.
ADP) 		PF01979
(Amidohydro_1) 		5 LEU A 298
THR A 119
LEU A 351
VAL A 350
HIS A 110
 None
 1.06A 3sp9B-2qt3A:
undetectable		 3sp9B-2qt3A:
21.48
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.
2vn7 GLUCOAMYLASE

(Trichoderma
reesei) 		PF00686
(CBM_20)
PF00723
(Glyco_hydro_15) 		5 LEU A 533
VAL A 515
THR A 579
LEU A 551
VAL A 549
 None
None
MAN  A 608 ( 2.4A)
None
None
 1.24A 3sp9B-2vn7A:
undetectable		 3sp9B-2vn7A:
18.04
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.
2y7r LYSR-TYPE REGULATORY
PROTEIN

(Burkholderia
sp. DNT) 		PF03466
(LysR_substrate) 		5 PHE A 111
THR A 104
HIS A 206
LEU A 138
VAL A 147
 None
 1.21A 3sp9B-2y7rA:
undetectable		 3sp9B-2y7rA:
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B
LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro)
PF08369
(PCP_red) 		5 LEU C  80
VAL C  37
HIS D  13
LEU C  70
TYR D  38
 None
None
None
None
PMR  C1414 (-4.6A)
 1.20A 3sp9B-2ynmC:
undetectable		 3sp9B-2ynmC:
19.91
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.
2z0f PUTATIVE
PHOSPHOGLUCOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A 335
PHE A 377
THR A 316
THR A 317
LEU A 412
 None
 1.07A 3sp9B-2z0fA:
undetectable		 3sp9B-2z0fA:
20.30
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.
2z2u UPF0026 PROTEIN
MJ0257

(Methanocaldococcus
jannaschii) 		PF04055
(Radical_SAM)
PF08608
(Wyosine_form) 		5 LEU A  25
THR A 159
HIS A 153
ILE A 149
VAL A  23
 None
 1.28A 3sp9B-2z2uA:
undetectable		 3sp9B-2z2uA:
22.32
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.
2z4g HISTIDINOL
PHOSPHATASE

(Thermus
thermophilus) 		PF02811
(PHP)
PF13263
(PHP_C) 		5 LEU A 209
VAL A 190
HIS A 226
VAL A 238
HIS A   7
 None
None
ZN  A 501 (-3.3A)
None
FE  A 503 (-3.4A)
 1.20A 3sp9B-2z4gA:
undetectable		 3sp9B-2z4gA:
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.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 VAL O 267
THR O 281
LEU O 391
VAL O 392
TYR O 132
 None
 1.17A 3sp9B-2zf5O:
undetectable		 3sp9B-2zf5O:
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.
3a62 RIBOSOMAL PROTEIN S6
KINASE BETA-1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 323
VAL A 346
HIS A 208
ILE A 155
LEU A 219
 None
 1.28A 3sp9B-3a62A:
undetectable		 3sp9B-3a62A:
22.38
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.
3agb RED CHLOROPHYLL
CATABOLITE
REDUCTASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF06405
(RCC_reductase) 		5 LEU A  81
VAL A 118
PHE A 141
LEU A 251
VAL A  73
 None
 1.27A 3sp9B-3agbA:
undetectable		 3sp9B-3agbA:
21.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 282
CYH A 285
HIS A 323
ILE A 326
TYR A 473
 MC5  A   1 (-4.4A)
MC5  A   1 (-3.6A)
MC5  A   1 (-3.8A)
MC5  A   1 ( 4.9A)
MC5  A   1 (-4.9A)
 0.88A 3sp9B-3b0qA:
36.2		 3sp9B-3b0qA:
61.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 282
CYH A 285
ILE A 326
HIS A 449
TYR A 473
 MC5  A   1 (-4.4A)
MC5  A   1 (-3.6A)
MC5  A   1 ( 4.9A)
MC5  A   1 (-3.9A)
MC5  A   1 (-4.9A)
 1.14A 3sp9B-3b0qA:
36.2		 3sp9B-3b0qA:
61.07
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.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 LEU A 220
VAL A 253
PHE A 254
THR A 507
ILE A 576
 None
 1.26A 3sp9B-3bmwA:
undetectable		 3sp9B-3bmwA:
16.40
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.
3btu GALACTOSE/LACTOSE
METABOLISM
REGULATORY PROTEIN
GAL80

(Saccharomyces
cerevisiae) 		PF01408
(GFO_IDH_MocA) 		5 LEU A  78
VAL A 102
ILE A 148
VAL A  23
HIS A 409
 None
 1.25A 3sp9B-3btuA:
undetectable		 3sp9B-3btuA:
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.
3c4a PROBABLE TRYPTOPHAN
HYDROXYLASE VIOD

(Chromobacterium
violaceum) 		no annotation 5 VAL A  95
THR A 282
THR A 283
LEU A 104
HIS A  53
 None
FAD  A 401 (-3.7A)
None
None
None
 1.14A 3sp9B-3c4aA:
undetectable		 3sp9B-3c4aA:
22.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3d5f PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 LEU A 255
VAL A 281
PHE A 282
CYH A 285
THR A 288
THR A 289
HIS A 323
ILE A 326
LEU A 339
VAL A 348
HIS A 449
TYR A 473
 None
L41  A 501 ( 4.7A)
L41  A 501 ( 4.9A)
L41  A 501 (-3.5A)
L41  A 501 (-3.0A)
L41  A 501 (-3.5A)
L41  A 501 (-3.8A)
None
L41  A 501 (-4.8A)
None
L41  A 501 (-3.9A)
L41  A 501 (-4.8A)
 0.97A 3sp9B-3d5fA:
38.7		 3sp9B-3d5fA:
99.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 LEU D 255
PHE D 282
ILE D 326
HIS D 449
TYR D 473
 None
None
PLB  D 701 ( 4.5A)
None
None
 1.29A 3sp9B-3dzuD:
34.3		 3sp9B-3dzuD:
42.93
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.
3fca CYSTEINE SYNTHASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 LEU A  95
THR A 167
ILE A 220
LEU A 130
HIS A 142
 None
 1.27A 3sp9B-3fcaA:
undetectable		 3sp9B-3fcaA:
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.
3fy7 CHLORIDE
INTRACELLULAR
CHANNEL PROTEIN 3

(Homo sapiens) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 VAL A 108
HIS A  21
ILE A 225
LEU A 206
VAL A 202
 None
 0.96A 3sp9B-3fy7A:
undetectable		 3sp9B-3fy7A:
25.64
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.
3h5t TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Corynebacterium
glutamicum) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		5 LEU A 263
VAL A 283
PHE A 281
THR A 301
THR A 316
 None
 1.25A 3sp9B-3h5tA:
undetectable		 3sp9B-3h5tA:
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.
3ig4 XAA-PRO
AMINOPEPTIDASE

(Bacillus
anthracis) 		PF00557
(Peptidase_M24)
PF05195
(AMP_N) 		5 LEU A 372
VAL A 289
THR A 296
THR A 297
ILE A 387
 None
 1.14A 3sp9B-3ig4A:
undetectable		 3sp9B-3ig4A:
21.32
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.
3kg6 CURF

(Lyngbya
majuscula) 		PF14765
(PS-DH) 		5 HIS A1840
ILE A1858
LEU A1947
VAL A1956
TYR A1844
 None
 1.22A 3sp9B-3kg6A:
undetectable		 3sp9B-3kg6A:
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.
3na6 SUCCINYLGLUTAMATE
DESUCCINYLASE/ASPART
OACYLASE

(Ruegeria sp.
TM1040) 		PF04952
(AstE_AspA) 		5 LEU A 232
THR A  41
ILE A  10
VAL A  80
TYR A 128
 None
 1.15A 3sp9B-3na6A:
undetectable		 3sp9B-3na6A:
23.71
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.
3okf 3-DEHYDROQUINATE
SYNTHASE

(Vibrio cholerae) 		PF01761
(DHQ_synthase) 		5 LEU A 204
VAL A 189
THR A 276
HIS A 255
LEU A 306
 None
None
None
CL  A 372 (-3.9A)
None
 1.28A 3sp9B-3okfA:
undetectable		 3sp9B-3okfA:
24.69
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		5 CYH A 325
THR A 328
ILE A 332
LEU A 369
VAL A 312
 None
 1.23A 3sp9B-3qi6A:
undetectable		 3sp9B-3qi6A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qld MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 190
VAL A 167
LEU A 152
VAL A 183
TYR A 299
 None
 1.28A 3sp9B-3qldA:
undetectable		 3sp9B-3qldA:
20.43
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.
3ru6 OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF00215
(OMPdecase) 		5 LEU A 116
PHE A  61
ILE A  55
LEU A 172
VAL A 152
 IOD  A 285 ( 4.8A)
None
None
None
None
 1.23A 3sp9B-3ru6A:
undetectable		 3sp9B-3ru6A:
25.36
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.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 VAL A  25
ILE A 267
VAL A  48
HIS A 380
TYR A 297
 None
 1.26A 3sp9B-3rv2A:
undetectable		 3sp9B-3rv2A:
19.42
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.
3u0a ACYL-COA
THIOESTERASE II
TESB2

(Mycobacterium
marinum) 		PF13622
(4HBT_3) 		5 VAL A 183
CYH A 187
LEU A  58
VAL A  55
HIS A  36
 None
 1.12A 3sp9B-3u0aA:
undetectable		 3sp9B-3u0aA:
24.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ved DYPB

(Rhodococcus
jostii) 		PF04261
(Dyp_perox) 		5 LEU A 313
VAL A  67
PHE A 302
LEU A 127
TYR A 260
 None
 1.21A 3sp9B-3vedA:
undetectable		 3sp9B-3vedA:
19.61
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.
4c3o HYDROGENASE-1 LARGE
SUBUNIT

(Salmonella
enterica) 		PF00374
(NiFeSe_Hases) 		5 LEU A 114
THR A 535
THR A 536
ILE A 401
VAL A  78
 None
NFU  A1004 (-3.7A)
None
None
None
 1.14A 3sp9B-4c3oA:
undetectable		 3sp9B-4c3oA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fgm AMINOPEPTIDASE N
FAMILY PROTEIN

(Idiomarina
loihiensis) 		PF05299
(Peptidase_M61)
PF13180
(PDZ_2) 		5 PHE A 105
THR A 109
ILE A 164
LEU A 125
HIS A 239
 None
 1.01A 3sp9B-4fgmA:
undetectable		 3sp9B-4fgmA:
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.
4gl3 PUTATIVE
GLUCOAMYLASE

(Bacteroides
uniformis) 		PF10091
(Glycoamylase) 		5 VAL A 348
THR A 352
ILE A 409
LEU A 380
TYR A 279
 None
 1.20A 3sp9B-4gl3A:
undetectable		 3sp9B-4gl3A:
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.
4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN

(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A 447
VAL A 445
PHE A 444
LEU A 459
VAL A 458
 MLY  A 448 ( 4.0A)
None
None
None
None
 1.27A 3sp9B-4gxrA:
undetectable		 3sp9B-4gxrA:
19.37
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.
4ln9 RIFAMYCIN POLYKETIDE
SYNTHASE

(Amycolatopsis
mediterranei) 		PF14765
(PS-DH) 		5 LEU A 260
PHE A 212
THR A  61
LEU A 250
VAL A 285
 None
 1.28A 3sp9B-4ln9A:
undetectable		 3sp9B-4ln9A:
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.
4lry PTS-DEPENDENT
DIHYDROXYACETONE
KINASE OPERON
REGULATORY PROTEIN
PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
DIHYDROXYACETONE-BIN
DING SUBUNIT DHAK

(Escherichia
coli) 		PF00989
(PAS)
PF02733
(Dak1) 		5 LEU C  54
CYH C  83
THR C  81
LEU A 119
HIS C  36
 None
 1.30A 3sp9B-4lryC:
undetectable		 3sp9B-4lryC:
20.72
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.
4mz1 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Campylobacter
jejuni) 		PF00478
(IMPDH) 		5 LEU A 233
VAL A  82
THR A  52
ILE A 423
LEU A  66
 None
 0.98A 3sp9B-4mz1A:
undetectable		 3sp9B-4mz1A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o7i 3'(2'),5'-BISPHOSPHA
TE NUCLEOTIDASE,
PUTATIVE

(Entamoeba
histolytica) 		PF00459
(Inositol_P) 		5 LEU A 136
VAL A  14
CYH A  18
THR A  21
THR A  22
 None
 0.89A 3sp9B-4o7iA:
undetectable		 3sp9B-4o7iA:
21.86
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.
4pmh PECTINESTERASE

(Sitophilus
oryzae) 		PF01095
(Pectinesterase) 		5 LEU A 312
VAL A 269
HIS A 191
LEU A 202
VAL A 228
 None
 1.20A 3sp9B-4pmhA:
undetectable		 3sp9B-4pmhA:
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.
4pqi IN2-1 FAMILY
PROTEIN, GLUTATHIONE
TRANSFERASE LAMBDA3

(Populus
trichocarpa) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 LEU A  35
PHE A  43
CYH A  41
THR A  40
TYR A 139
 None
GSH  A 301 (-3.8A)
GSH  A 301 (-2.0A)
None
None
 0.99A 3sp9B-4pqiA:
undetectable		 3sp9B-4pqiA:
24.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A4232
VAL A4286
THR A4282
LEU A4220
VAL A4245
 None
 1.18A 3sp9B-4rh7A:
undetectable		 3sp9B-4rh7A:
6.22
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A3204
PHE A3232
CYH A3235
THR A3238
LEU A3158
 None
 1.15A 3sp9B-4tktA:
undetectable		 3sp9B-4tktA:
19.81
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.
4txw HYALURONOGLUCOSAMINI
DASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		5 LEU A  41
VAL A 131
THR A  77
LEU A 124
VAL A  47
 None
 1.12A 3sp9B-4txwA:
undetectable		 3sp9B-4txwA:
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.
4uav HALOACID
DEHALOGENASE-LIKE
HYDROLASE
DOMAIN-CONTAINING
PROTEIN AT3G48420

(Arabidopsis
thaliana) 		PF13419
(HAD_2) 		5 LEU A  87
VAL A 196
PHE A 224
LEU A 188
VAL A 184
 None
 1.14A 3sp9B-4uavA:
undetectable		 3sp9B-4uavA:
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		5 VAL A 218
ILE A 113
LEU A 156
VAL A 187
HIS A 123
 None
 1.13A 3sp9B-4w5kA:
undetectable		 3sp9B-4w5kA:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wpx PUTATIVE SAC3 FAMILY
PROTEIN
PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 LEU C  72
VAL B1121
THR B1113
LEU C 138
HIS C  56
 None
 1.28A 3sp9B-4wpxC:
undetectable		 3sp9B-4wpxC:
24.04
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.
4y4n PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanotorris
igneus) 		PF01946
(Thi4) 		5 LEU A  95
VAL A  80
THR A  68
HIS A 176
LEU A 116
 None
None
None
FE2  A 301 ( 3.4A)
None
 1.25A 3sp9B-4y4nA:
undetectable		 3sp9B-4y4nA:
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.
5b25 CALCIUM/CALMODULIN-D
EPENDENT
3',5'-CYCLIC
NUCLEOTIDE
PHOSPHODIESTERASE 1B

(Homo sapiens) 		PF00233
(PDEase_I) 		5 THR A 189
ILE A 194
LEU A 253
VAL A 245
TYR A 150
 None
 1.17A 3sp9B-5b25A:
undetectable		 3sp9B-5b25A:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bsw 4-COUMARATE--COA
LIGASE 2

(Nicotiana
tabacum) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A  69
VAL A  65
ILE A 257
LEU A  84
VAL A 129
 None
 1.29A 3sp9B-5bswA:
undetectable		 3sp9B-5bswA:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c0u ALKYLMERCURY LYASE

(Escherichia
coli) 		PF03243
(MerB)
PF12324
(HTH_15) 		5 LEU A  10
VAL A  14
THR A  63
ILE A  71
LEU A  28
 None
 1.21A 3sp9B-5c0uA:
undetectable		 3sp9B-5c0uA:
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.
5c9i PROTEIN RELATED TO
PENICILLIN ACYLASE

(Acidovorax sp.
MR-S7) 		PF01804
(Penicil_amidase) 		5 LEU A 612
VAL A 607
LEU A 558
VAL A 557
TYR A 698
 None
 1.25A 3sp9B-5c9iA:
undetectable		 3sp9B-5c9iA:
15.26
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.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 5 VAL A  39
PHE A  42
HIS A  97
ILE A 106
LEU A 131
 None
 1.20A 3sp9B-5hdtA:
undetectable		 3sp9B-5hdtA:
14.72
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER

(Shigella
flexneri) 		PF02395
(Peptidase_S6) 		5 THR A 619
THR A 620
HIS A 611
ILE A 614
HIS A 566
 None
 1.23A 3sp9B-5j44A:
undetectable		 3sp9B-5j44A:
13.46
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.
5j4r WELO5

(Hapalosiphon
welwitschii) 		no annotation 5 THR A 151
ILE A  84
LEU A  59
VAL A  55
TYR A  99
 None
 1.11A 3sp9B-5j4rA:
undetectable		 3sp9B-5j4rA:
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.
5jxf ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Flavobacterium
psychrophilum) 		PF10459
(Peptidase_S46) 		5 LEU A  79
VAL A 688
PHE A 690
LEU A 707
VAL A 251
 None
 1.27A 3sp9B-5jxfA:
undetectable		 3sp9B-5jxfA:
18.64
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.
5jxm PRIB

(Streptomyces
sp. RM-5-8) 		PF11991
(Trp_DMAT) 		5 LEU A 203
VAL A 233
LEU A 212
HIS A 312
TYR A 380
 None
None
None
None
TRS  A 501 ( 4.5A)
 1.31A 3sp9B-5jxmA:
undetectable		 3sp9B-5jxmA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1b WD REPEAT-CONTAINING
PROTEIN 48

(Homo sapiens) 		PF00400
(WD40)
PF11816
(DUF3337) 		5 VAL B 132
THR B 161
THR B 160
LEU B 113
VAL B  99
 None
 1.11A 3sp9B-5k1bB:
undetectable		 3sp9B-5k1bB:
18.69
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.
5lp5 ROD
SHAPE-DETERMINING
PROTEIN (MREC)

(Helicobacter
pylori) 		PF04085
(MreC) 		5 LEU C 227
VAL C 180
PHE C 169
ILE C 125
VAL C 210
 None
 1.30A 3sp9B-5lp5C:
undetectable		 3sp9B-5lp5C:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m04 GTPASE OBGE/CGTA

(Escherichia
coli) 		PF01018
(GTP1_OBG)
PF01926
(MMR_HSR1) 		5 VAL A 321
CYH A 325
ILE A 332
LEU A 242
VAL A 281
 None
 1.15A 3sp9B-5m04A:
undetectable		 3sp9B-5m04A:
24.38
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.
5mxp -

(-) 		no annotation 5 PHE A 169
THR A  42
HIS A 104
LEU A 187
HIS A 273
 ACT  A 401 (-4.5A)
None
None
None
ACT  A 401 ( 4.3A)
 1.21A 3sp9B-5mxpA:
undetectable		 3sp9B-5mxpA:
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.
5nn8 LYSOSOMAL
ALPHA-GLUCOSIDASE

(Homo sapiens) 		no annotation 5 VAL A 211
THR A 234
THR A 235
LEU A 169
VAL A 171
 None
None
NAG  A1004 ( 4.2A)
None
None
 0.85A 3sp9B-5nn8A:
undetectable		 3sp9B-5nn8A:
16.00
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.
5uuu BETA-ADRENERGIC
RECEPTOR KINASE 1

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 LEU A 424
VAL A 447
HIS A 307
ILE A 254
LEU A 318
 None
 1.26A 3sp9B-5uuuA:
undetectable		 3sp9B-5uuuA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xr2 PROTEIN/NUCLEIC ACID
DEGLYCASE HCHA

(Staphylococcus
aureus) 		no annotation 5 VAL A  98
THR A 123
HIS A  87
LEU A 108
VAL A 106
 None
 1.28A 3sp9B-5xr2A:
undetectable		 3sp9B-5xr2A:
23.40
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.
5zvs VP2

(Aquareovirus C) 		no annotation 5 LEU 2 452
VAL 21127
THR 2 463
ILE 2 497
LEU 2 985
 None
 1.15A 3sp9B-5zvs2:
undetectable		 3sp9B-5zvs2:
14.67
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 5 VAL A 126
THR A   6
THR A   7
ILE A  29
VAL A  34
 None
None
None
None
FAD  A 502 (-4.9A)
 1.14A 3sp9B-6cmzA:
undetectable		 3sp9B-6cmzA:
14.98
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.
6fuz KINESIN LIGHT CHAIN
1,KINESIN LIGHT
CHAIN
1,C-JUN-AMINO-TERMIN
AL
KINASE-INTERACTING
PROTEIN 1
NANOBODY

(Homo sapiens;
Lama;
Mus musculus) 		no annotation 5 PHE N  27
THR N  53
ILE N  51
LEU A 366
VAL A 380
 None
 0.87A 3sp9B-6fuzN:
undetectable		 3sp9B-6fuzN:
12.37