SIMILAR PATTERNS OF AMINO ACIDS FOR 5V1T_A_SAMA605

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.
1azw PROLINE
IMINOPEPTIDASE

(Xanthomonas
citri) 		PF00561
(Abhydrolase_1) 		5 PHE A  55
ARG A  73
TYR A  61
THR A 309
GLU A  27
 None
 1.46A 5v1tA-1azwA:
undetectable		 5v1tA-1azwA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e8t HEMAGGLUTININ-NEURAM
INIDASE

(Avian
avulavirus 1) 		PF00423
(HN) 		5 PHE A 178
LEU A 211
VAL A 534
THR A 528
GLU A 158
 None
 1.49A 5v1tA-1e8tA:
undetectable		 5v1tA-1e8tA:
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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN I
CYTOCHROME C1
UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
UBIQUINONE-BINDING
PROTEIN QP-C

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF02167
(Cytochrom_C1)
PF02939
(UcrQ) 		5 LEU A 250
THR G  25
VAL D 301
ASN D 303
GLU A 182
 None
 1.15A 5v1tA-1ezvA:
undetectable		 5v1tA-1ezvA:
24.66
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.
1h2b ALCOHOL
DEHYDROGENASE

(Aeropyrum
pernix) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 198
THR A 172
VAL A 309
SER A 307
THR A 271
 NAJ  A1361 (-3.7A)
NAJ  A1361 (-3.4A)
NAJ  A1361 (-3.7A)
None
None
 1.17A 5v1tA-1h2bA:
undetectable		 5v1tA-1h2bA:
22.53
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.
1i41 CYSTATHIONINE
GAMMA-SYNTHASE

(Nicotiana
tabacum) 		PF01053
(Cys_Met_Meta_PP) 		5 PHE A 426
LEU A 328
VAL A 366
VAL A 396
SER A 394
 None
 1.30A 5v1tA-1i41A:
undetectable		 5v1tA-1i41A:
21.54
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.
1m1c MAJOR COAT PROTEIN

(Saccharomyces
cerevisiae
virus L-A) 		PF09220
(LA-virus_coat) 		5 LEU A 410
THR A 414
VAL A 476
ASN A   8
THR A 346
 None
 1.39A 5v1tA-1m1cA:
undetectable		 5v1tA-1m1cA:
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.
1oul STRINGENT STARVATION
PROTEIN B HOMOLOG

(Haemophilus
influenzae) 		PF04386
(SspB) 		5 PHE A  75
LEU A  52
VAL A  38
ASN A  39
SER A  79
 None
 1.45A 5v1tA-1oulA:
undetectable		 5v1tA-1oulA:
14.44
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.
1s4f RNA-DEPENDENT RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		5 PHE A 462
LEU A 470
THR A 346
ASN A 418
THR A 454
 None
 1.45A 5v1tA-1s4fA:
undetectable		 5v1tA-1s4fA:
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.
1u3t ALCOHOL
DEHYDROGENASE ALPHA
CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 PHE A 266
THR A 190
SER A 193
VAL A 262
SER A 278
 None
 1.06A 5v1tA-1u3tA:
undetectable		 5v1tA-1u3tA:
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.
1uyw FAB ANTIBODY HEAVY
CHAIN
FAB ANTIBODY LIGHT
CHAIN

(Mus musculus;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 LEU L 160
THR L 178
VAL L 133
SER L 131
THR H 117
 None
 1.39A 5v1tA-1uywL:
undetectable		 5v1tA-1uywL:
17.32
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.
1xdn RNA EDITING LIGASE
MP52

(Trypanosoma
brucei) 		PF09414
(RNA_ligase) 		5 PHE A 131
LEU A 160
VAL A 190
THR A 132
GLU A 203
 None
 1.47A 5v1tA-1xdnA:
undetectable		 5v1tA-1xdnA:
21.16
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.
2e6e 5'-NUCLEOTIDASE SURE

(Thermus
thermophilus) 		PF01975
(SurE) 		5 VAL A 217
ASN A 164
ARG A 214
THR A   6
GLU A 104
 None
 1.14A 5v1tA-2e6eA:
undetectable		 5v1tA-2e6eA:
18.30
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.
2eae ALPHA-FUCOSIDASE

(Bifidobacterium
bifidum) 		PF14498
(Glyco_hyd_65N_2) 		5 THR A 823
VAL A 817
ASN A 435
SER A 327
GLU A 438
 None
 1.49A 5v1tA-2eaeA:
undetectable		 5v1tA-2eaeA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
cruzi) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		5 LEU A 171
ASN A 277
VAL A 488
ARG A 452
SER A 141
 None
 1.15A 5v1tA-2h2qA:
undetectable		 5v1tA-2h2qA:
22.30
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.
2hi9 PLASMA SERINE
PROTEASE INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		5 THR A 141
VAL A 181
TYR A 183
THR A 161
GLU A 327
 None
 1.24A 5v1tA-2hi9A:
undetectable		 5v1tA-2hi9A:
20.08
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.
2ijx DNA POLYMERASE
SLIDING CLAMP A

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 PHE A  67
LEU A  74
VAL A   8
VAL A   3
SER A  91
 None
 1.28A 5v1tA-2ijxA:
undetectable		 5v1tA-2ijxA:
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.
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 PHE A 209
LEU A  65
THR A 106
VAL A 135
TYR A 199
 None
 1.49A 5v1tA-2w8sA:
undetectable		 5v1tA-2w8sA:
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.
2xy4 ZINC ABC
TRANSPORTER,
PERIPLASMIC
ZINC-BINDING PROTEIN

(Salmonella
enterica) 		PF01297
(ZnuA) 		5 LEU A 291
THR A  49
VAL A  28
TYR A  62
SER A  58
 None
 1.24A 5v1tA-2xy4A:
undetectable		 5v1tA-2xy4A:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a21 PUTATIVE SECRETED
ALPHA-GALACTOSIDASE

(Streptomyces
avermitilis) 		PF00652
(Ricin_B_lectin)
PF16499
(Melibiase_2) 		5 THR A 571
VAL A 579
VAL A 347
ARG A 575
SER A 386
 None
None
None
GOL  A 911 (-3.9A)
None
 1.39A 5v1tA-3a21A:
4.2		 5v1tA-3a21A:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b05 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Sulfolobus
shibatae) 		PF01070
(FMN_dh) 		5 VAL A 265
ARG A 354
TYR A 208
SER A 209
GLU A 202
 None
 1.48A 5v1tA-3b05A:
5.3		 5v1tA-3b05A:
23.11
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.
3cq0 PUTATIVE
TRANSALDOLASE
YGR043C

(Saccharomyces
cerevisiae) 		PF00923
(TAL_FSA) 		5 VAL A  27
ASN A 253
ARG A 104
SER A 277
GLU A 233
 None
 1.37A 5v1tA-3cq0A:
4.7		 5v1tA-3cq0A:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dea CUTINASE

(Colletotrichum
gloeosporioides) 		PF01083
(Cutinase) 		5 LEU A 149
SER A 132
VAL A  89
TYR A  93
THR A 106
 None
 1.37A 5v1tA-3deaA:
undetectable		 5v1tA-3deaA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3do8 PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE

(Archaeoglobus
fulgidus) 		PF01467
(CTP_transf_like) 		5 PHE A   9
LEU A   5
VAL A 120
SER A  93
GLU A  14
 None
 1.20A 5v1tA-3do8A:
undetectable		 5v1tA-3do8A:
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 LEU A  73
THR A  76
VAL A 144
TYR A 141
THR A 548
 None
 1.27A 5v1tA-3fedA:
undetectable		 5v1tA-3fedA:
22.83
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 THR A  76
ASN A 146
VAL A 144
TYR A 141
THR A 548
 None
 1.27A 5v1tA-3fedA:
undetectable		 5v1tA-3fedA:
22.83
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.
3fvr ACETYL XYLAN
ESTERASE

(Bacillus
pumilus) 		PF05448
(AXE1) 		5 THR A 126
SER A  67
VAL A  38
ARG A 151
GLU A  34
 None
 1.37A 5v1tA-3fvrA:
undetectable		 5v1tA-3fvrA:
19.69
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.
3h14 AMINOTRANSFERASE,
CLASSES I AND II

(Ruegeria
pomeroyi) 		PF00155
(Aminotran_1_2) 		5 PHE A 232
LEU A  80
VAL A  94
VAL A 239
SER A 229
 GOL  A 501 (-4.7A)
GOL  A 501 (-4.2A)
None
None
None
 1.46A 5v1tA-3h14A:
undetectable		 5v1tA-3h14A:
21.97
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.
3i58 O-METHYLTRANSFERASE

(Streptomyces
carzinostaticus) 		PF00891
(Methyltransf_2) 		5 LEU A 187
VAL A 240
SER A 242
VAL A 324
TYR A 323
 None
None
SAH  A 401 (-2.8A)
None
None
 1.32A 5v1tA-3i58A:
undetectable		 5v1tA-3i58A:
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.
3i5m PUTATIVE
LEUCOANTHOCYANIDIN
REDUCTASE 1

(Vitis vinifera) 		PF05368
(NmrA) 		5 PHE A 204
ASN A 226
VAL A 196
THR A 205
GLU A 309
 None
 1.32A 5v1tA-3i5mA:
2.8		 5v1tA-3i5mA:
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.
3iv6 PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		no annotation 5 LEU A 112
VAL A 136
ARG A 256
THR A 248
GLU A 237
 None
 1.46A 5v1tA-3iv6A:
undetectable		 5v1tA-3iv6A:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jd8 NIEMANN-PICK C1
PROTEIN

(Homo sapiens) 		PF02460
(Patched)
PF12349
(Sterol-sensing)
PF16414
(NPC1_N) 		5 PHE A 513
LEU A 547
ASN A 557
VAL A 429
THR A 511
 None
None
NAG  A1306 (-2.8A)
None
None
 1.45A 5v1tA-3jd8A:
undetectable		 5v1tA-3jd8A:
15.32
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.
3ktd PREPHENATE
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF02153
(PDH) 		5 LEU A  70
THR A  97
VAL A 120
SER A 122
VAL A 181
 None
 1.48A 5v1tA-3ktdA:
undetectable		 5v1tA-3ktdA:
21.35
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.
3oja LEUCINE-RICH IMMUNE
MOLECULE 1

(Anopheles
gambiae) 		PF00560
(LRR_1) 		5 LEU A 198
VAL A 206
VAL A 210
SER A 189
GLU A 185
 None
 1.50A 5v1tA-3ojaA:
undetectable		 5v1tA-3ojaA:
22.10
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.
3ufb TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT

(Vibrio
vulnificus) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		5 PHE A 169
LEU A  61
ASN A 273
THR A  17
GLU A 237
 None
 1.47A 5v1tA-3ufbA:
undetectable		 5v1tA-3ufbA:
23.77
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.
3urh DIHYDROLIPOYL
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 PHE A 233
LEU A 222
THR A 355
SER A 192
VAL A 180
 None
 1.49A 5v1tA-3urhA:
undetectable		 5v1tA-3urhA:
22.73
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.
3zrh UBIQUITIN
THIOESTERASE ZRANB1

(Homo sapiens) 		PF02338
(OTU) 		5 LEU A 398
VAL A 680
VAL A 590
ARG A 669
GLU A 593
 None
 1.40A 5v1tA-3zrhA:
undetectable		 5v1tA-3zrhA:
22.10
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.
4a5w COMPLEMENT C5

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2) 		5 LEU A1259
VAL A1304
SER A1301
VAL A 991
THR A1290
 None
 1.46A 5v1tA-4a5wA:
undetectable		 5v1tA-4a5wA:
15.05
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.
4bhi GAMMA-BUTYROBETAINE
DIOXYGENASE

(Homo sapiens) 		PF02668
(TauD)
PF06155
(DUF971) 		5 PHE A 317
LEU A 346
THR A 203
ASN A 290
GLU A 279
 None
 1.36A 5v1tA-4bhiA:
undetectable		 5v1tA-4bhiA:
22.90
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.
4ee8 PRENYLTRANSFERASE

(Streptomyces
cinnamonensis) 		PF11468
(PTase_Orf2) 		5 THR A  64
VAL A  45
SER A  47
VAL A 270
THR A 234
 None
 1.25A 5v1tA-4ee8A:
undetectable		 5v1tA-4ee8A:
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.
4ejs ELONGATOR COMPLEX
PROTEIN 6

(Saccharomyces
cerevisiae) 		no annotation 5 LEU C 252
THR C 247
ASN C  30
VAL C 180
THR C  52
 None
 1.48A 5v1tA-4ejsC:
undetectable		 5v1tA-4ejsC:
21.77
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.
4fl0 AMINOTRANSFERASE
ALD1

(Arabidopsis
thaliana) 		PF00155
(Aminotran_1_2) 		5 LEU A 337
THR A 124
VAL A 136
SER A 139
GLU A 278
 None
 1.41A 5v1tA-4fl0A:
undetectable		 5v1tA-4fl0A:
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.
4fmv GLUCURONOARABINOXYLA
N
ENDO-1,4-BETA-XYLANA
SE

([Clostridium]
papyrosolvens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 PHE A 338
LEU A 376
SER A 350
VAL A 348
SER A 371
 None
 1.46A 5v1tA-4fmvA:
2.6		 5v1tA-4fmvA:
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.
4hrt HEMOGLOBIN B CHAIN

(Scapharca
inaequivalvis) 		PF00042
(Globin) 		5 LEU B 143
VAL B  95
ARG B  91
SER B  28
THR B  34
 None
 1.22A 5v1tA-4hrtB:
undetectable		 5v1tA-4hrtB:
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.
4hx3 NEUTRAL PROTEINASE
INHIBITOR SCNPI

(Streptomyces
caespitosus) 		PF00720
(SSI) 		5 PHE B  10
LEU B  56
THR B  52
ASN B  50
THR B  27
 None
 1.39A 5v1tA-4hx3B:
undetectable		 5v1tA-4hx3B:
15.25
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.
4j3b M1 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 THR A 539
SER A 530
ASN A 527
VAL A 523
TYR A 580
 None
None
None
None
ARG  A1101 (-4.5A)
 1.43A 5v1tA-4j3bA:
undetectable		 5v1tA-4j3bA:
19.11
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.
4j4x NP PROTEIN

(Sandfly fever
Naples
phlebovirus) 		PF05733
(Tenui_N) 		5 LEU A 124
THR A 120
VAL A 117
SER A 113
THR A 185
 None
 1.44A 5v1tA-4j4xA:
undetectable		 5v1tA-4j4xA:
20.69
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.
4jfc ENOYL-COA HYDRATASE

(Polaromonas sp.
JS666) 		PF00378
(ECH_1) 		5 LEU A  18
VAL A 105
VAL A 101
TYR A  97
SER A  93
 None
 1.07A 5v1tA-4jfcA:
2.9		 5v1tA-4jfcA:
22.25
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.
4l5f HEAVY CHAIN OF E106
ANTIBODY (VH AND CH1
OF IGG2C)
LIGHT CHAIN OF E106
ANTIBODY (KAPPA)

(Mus musculus;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 LEU L 160
THR L 178
VAL L 133
SER L 131
THR H 117
 None
 1.40A 5v1tA-4l5fL:
undetectable		 5v1tA-4l5fL:
18.90
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.
4lzh L,D-TRANSPEPTIDASE

(Klebsiella
pneumoniae) 		PF03734
(YkuD) 		5 LEU A 271
THR A 279
VAL A 278
VAL A 301
ARG A  33
 None
 1.32A 5v1tA-4lzhA:
undetectable		 5v1tA-4lzhA:
19.78
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.
4nik SINGLE-CHAIN FV
FRAGMENT ANTIBODY

(Homo sapiens) 		PF07686
(V-set) 		5 LEU B  83
VAL B  39
ASN B  37
ARG B 233
SER B  57
 None
 1.44A 5v1tA-4nikB:
undetectable		 5v1tA-4nikB:
19.48
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.
4nru RNA DEPENDENT RNA
POLYMERASE

(Norwalk virus) 		PF00680
(RdRP_1) 		5 LEU A  94
THR A  97
TYR A 341
THR A 306
GLU A 337
 None
None
2NG  A1101 ( 4.8A)
None
None
 1.27A 5v1tA-4nruA:
undetectable		 5v1tA-4nruA:
22.90
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.
4oyy CUTINASE

(Humicola
insolens) 		PF01083
(Cutinase) 		5 LEU A 118
VAL A  99
VAL A  58
TYR A  62
THR A  75
 None
 1.21A 5v1tA-4oyyA:
undetectable		 5v1tA-4oyyA:
17.38
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.
4pqg GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
pneumoniae) 		PF00534
(Glycos_transf_1) 		5 VAL A  17
ARG A 328
TYR A 246
SER A 247
GLU A 332
 NAG  A 602 (-4.6A)
UDP  A 601 (-3.8A)
None
None
NAG  A 602 ( 3.9A)
 1.39A 5v1tA-4pqgA:
2.0		 5v1tA-4pqgA:
24.50
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.
4qj4 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 PHE B  50
SER B 148
ASN B 150
ARG B 298
GLU B 214
 None
 1.49A 5v1tA-4qj4B:
undetectable		 5v1tA-4qj4B:
21.64
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.
4r0v FE-HYDROGENASE

(Chlamydomonas
reinhardtii) 		PF02256
(Fe_hyd_SSU)
PF02906
(Fe_hyd_lg_C) 		5 LEU A 122
VAL A 220
VAL A  95
THR A 110
GLU A 256
 None
 1.33A 5v1tA-4r0vA:
undetectable		 5v1tA-4r0vA:
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.
4r1u CINNAMOYL COA
REDUCTASE

(Medicago
truncatula) 		PF01370
(Epimerase) 		5 THR A 121
VAL A 122
SER A 118
ASN A 178
THR A   7
 None
 1.49A 5v1tA-4r1uA:
undetectable		 5v1tA-4r1uA:
24.26
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.
4wcx BIOTIN AND THIAMIN
SYNTHESIS ASSOCIATED

(Thermoanaerobacter
italicus) 		PF04055
(Radical_SAM)
PF06968
(BATS) 		5 PHE A  63
VAL A 287
VAL A 296
SER A 324
GLU A 314
 None
 1.46A 5v1tA-4wcxA:
13.0		 5v1tA-4wcxA:
25.87
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.
4xuy PROBABLE
ENDO-1,4-BETA-XYLANA
SE C

(Aspergillus
niger) 		PF00331
(Glyco_hydro_10) 		5 LEU A 236
THR A 234
VAL A 261
SER A 232
SER A 206
 None
 1.27A 5v1tA-4xuyA:
4.9		 5v1tA-4xuyA:
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.
4y21 PROTEIN UNC-13
HOMOLOG A

(Rattus
norvegicus) 		PF06292
(DUF1041)
PF10540
(Membr_traf_MHD) 		5 LEU A 249
VAL A 270
SER A 267
VAL A 332
SER A 323
 None
 1.42A 5v1tA-4y21A:
undetectable		 5v1tA-4y21A:
22.30
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.
4y5j MINI SPINDLES TOG3

(Drosophila
melanogaster) 		no annotation 5 PHE A 623
LEU A 593
THR A 637
VAL A 663
SER A 621
 None
 1.33A 5v1tA-4y5jA:
undetectable		 5v1tA-4y5jA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z5y COENZYME PQQ
SYNTHESIS PROTEIN B

(Pseudomonas
putida) 		PF12706
(Lactamase_B_2) 		5 PHE A 159
LEU A 200
VAL A 256
THR A 157
GLU A 205
 None
 1.20A 5v1tA-4z5yA:
undetectable		 5v1tA-4z5yA:
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.
5bqn BOTULINUM NEUROTOXIN
TYPE D,BOTULINUM
NEUROTOXIN TYPE D

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07952
(Toxin_trans) 		5 PHE A 202
SER A 411
ASN A 414
THR A 373
GLU A 416
 None
 1.36A 5v1tA-5bqnA:
undetectable		 5v1tA-5bqnA:
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.
5dlb CHAPERONE ESPG3

(Mycobacterium
marinum) 		PF14011
(ESX-1_EspG) 		5 LEU A 128
VAL A 105
VAL A 214
TYR A 213
SER A 212
 None
None
None
GOL  A 305 (-3.7A)
None
 1.46A 5v1tA-5dlbA:
undetectable		 5v1tA-5dlbA:
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.
5e0q ANTI-NUP98 NANOBODY
TP377
NUCLEAR PORE COMPLEX
PROTEIN NUP98-NUP96

(Vicugna pacos;
Xenopus
tropicalis) 		PF07686
(V-set)
PF04096
(Nucleoporin2) 		5 SER A  56
ASN A  33
ARG A  29
THR B 729
GLU B 745
 None
 1.29A 5v1tA-5e0qA:
undetectable		 5v1tA-5e0qA:
14.82
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.
5esa ANTI-HCV E2
GLYCOPROTEIN FAB
HEAVY CHAIN
ANTI-HCV E2
GLYCOPROTEIN FAB
LIGHT CHAIN

(Homo sapiens;
Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
PF07654
(C1-set)
PF07686
(V-set) 		5 LEU B 159
THR B 177
VAL B 132
SER B 130
THR A 123
 None
 1.37A 5v1tA-5esaB:
undetectable		 5v1tA-5esaB:
17.86
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.
5f84 O-GLUCOSYLTRANSFERAS
E RUMI

(Drosophila
melanogaster) 		PF05686
(Glyco_transf_90) 		5 LEU A 324
VAL A 309
ASN A 289
SER A 171
THR A 173
 None
 1.32A 5v1tA-5f84A:
undetectable		 5v1tA-5f84A:
20.45
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.
5giv CARBOXYPEPTIDASE 1

(Deinococcus
radiodurans) 		PF02074
(Peptidase_M32) 		5 LEU A 493
VAL A 427
SER A 429
ASN A 426
TYR A 262
 None
 1.30A 5v1tA-5givA:
undetectable		 5v1tA-5givA:
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.
5hlb PENICILLIN-BINDING
PROTEIN 1B

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF14814
(UB2H) 		5 PHE A 327
LEU A 229
THR A 232
TYR A 334
SER A 331
 None
 1.40A 5v1tA-5hlbA:
undetectable		 5v1tA-5hlbA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hns NIEMANN-PICK C1
PROTEIN

(Homo sapiens) 		no annotation 5 PHE A 513
LEU A 547
ASN A 557
VAL A 429
TYR A 420
 None
None
NAG  A 703 (-2.5A)
NAG  A 703 ( 4.7A)
None
 1.33A 5v1tA-5hnsA:
undetectable		 5v1tA-5hnsA:
21.33
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 THR B 454
SER B 125
VAL B 102
SER B 105
THR B 956
 None
 1.30A 5v1tA-5ip9B:
undetectable		 5v1tA-5ip9B:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER

(Shigella
flexneri) 		PF02395
(Peptidase_S6) 		5 LEU A 818
THR A 799
VAL A 772
SER A 777
THR A 830
 None
 1.27A 5v1tA-5j44A:
undetectable		 5v1tA-5j44A:
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.
5kss 5'-NUCLEOTIDASE SURE

(Xylella
fastidiosa) 		PF01975
(SurE) 		5 LEU A 183
THR A 232
SER A 230
ASN A 166
VAL A 126
 None
 1.27A 5v1tA-5kssA:
undetectable		 5v1tA-5kssA:
17.44
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.
5kvc HALOHYDRIN
DEHALOGENASE

(Agrobacterium
tumefaciens) 		PF13561
(adh_short_C2) 		5 LEU A 155
SER A  78
TYR A 145
THR A 134
GLU A 102
 None
None
IMD  A 302 (-4.5A)
IMD  A 302 (-4.0A)
EDO  A 308 (-3.5A)
 1.30A 5v1tA-5kvcA:
undetectable		 5v1tA-5kvcA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5of4 TFIIH BASAL
TRANSCRIPTION FACTOR
COMPLEX HELICASE XPD
SUBUNIT

(Homo sapiens) 		PF06733
(DEAD_2)
PF06777
(HBB)
PF13307
(Helicase_C_2) 		5 LEU B  52
THR B 457
ARG B 666
TYR B 207
GLU B  79
 None
 1.37A 5v1tA-5of4B:
undetectable		 5v1tA-5of4B:
20.39
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.
5u4n FRUCTOSE-1

(Neisseria
gonorrhoeae) 		PF01116
(F_bP_aldolase) 		5 PHE A  99
LEU A  62
ASN A  24
ARG A 281
GLU A 157
 None
None
PO4  A 402 ( 4.7A)
None
PO4  A 402 (-3.6A)
 1.12A 5v1tA-5u4nA:
4.0		 5v1tA-5u4nA:
23.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v1s RADICAL SAM

(Streptococcus
suis) 		PF04055
(Radical_SAM)
PF13394
(Fer4_14) 		10 LEU A 158
THR A 185
VAL A 208
SER A 210
ASN A 247
VAL A 249
TYR A 278
SER A 279
THR A 285
GLU A 319
 SAM  A 604 ( 4.0A)
SAM  A 604 (-3.8A)
None
SAM  A 604 (-2.4A)
SAM  A 604 (-3.8A)
SAM  A 604 (-4.2A)
SAM  A 604 ( 4.9A)
SAM  A 604 (-4.9A)
None
None
 0.52A 5v1tA-5v1sA:
56.5		 5v1tA-5v1sA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v1s RADICAL SAM

(Streptococcus
suis) 		PF04055
(Radical_SAM)
PF13394
(Fer4_14) 		8 LEU A 158
THR A 185
VAL A 208
SER A 210
VAL A 249
ARG A 272
TYR A 278
GLU A 319
 SAM  A 604 ( 4.0A)
SAM  A 604 (-3.8A)
None
SAM  A 604 (-2.4A)
SAM  A 604 (-4.2A)
None
SAM  A 604 ( 4.9A)
None
 0.61A 5v1tA-5v1sA:
56.5		 5v1tA-5v1sA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v1s RADICAL SAM

(Streptococcus
suis) 		PF04055
(Radical_SAM)
PF13394
(Fer4_14) 		6 PHE A 125
ASN A 247
VAL A 249
TYR A 278
THR A 285
GLU A 319
 SAM  A 604 (-4.8A)
SAM  A 604 (-3.8A)
SAM  A 604 (-4.2A)
SAM  A 604 ( 4.9A)
None
None
 0.91A 5v1tA-5v1sA:
56.5		 5v1tA-5v1sA:
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.
5w4z RIBOFLAVIN LYASE

(Herbiconiux) 		no annotation 5 LEU A 393
VAL A 106
ASN A 137
SER A 232
THR A 342
 None
None
None
9WY  A 501 (-3.6A)
9WY  A 501 (-3.7A)
 1.39A 5v1tA-5w4zA:
5.3		 5v1tA-5w4zA:
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.
5xh9 EXTRACELLULAR
INVERTASE

(Aspergillus
kawachii) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 VAL A 573
SER A 585
ARG A 589
TYR A 342
THR A 272
 None
 1.48A 5v1tA-5xh9A:
undetectable		 5v1tA-5xh9A:
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.
5xu5 ENDO-1,4-BETA-MANNAN
ASE

(Rhizopus
microsporus) 		no annotation 5 PHE B  63
LEU B 120
SER B 100
SER B  52
THR B  77
 None
 1.47A 5v1tA-5xu5B:
undetectable		 5v1tA-5xu5B:
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.
5xw5 TYROSINE-PROTEIN
PHOSPHATASE CDC14

(Saccharomyces
cerevisiae) 		PF00782
(DSPc)
PF14671
(DSPn) 		5 PHE A 304
LEU A 156
THR A 182
THR A 305
GLU A 270
 None
 1.44A 5v1tA-5xw5A:
undetectable		 5v1tA-5xw5A:
25.51
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.
5zvs VP2

(Aquareovirus C) 		no annotation 5 LEU 2   4
ARG 2 846
SER 2 186
THR 2  56
GLU 2 843
 None
 1.37A 5v1tA-5zvs2:
undetectable		 5v1tA-5zvs2:
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.
6bgz LYSINE-SPECIFIC
DEMETHYLASE 5A,
LINKED KDM5A JMJ
DOMAIN

(Homo sapiens) 		no annotation 5 ASN A 493
VAL A 564
TYR A 490
SER A 489
THR A 588
 DNV  A 601 ( 4.3A)
None
None
None
None
 1.44A 5v1tA-6bgzA:
undetectable		 5v1tA-6bgzA:
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.
6dfp VCA0883

(Vibrio cholerae) 		no annotation 5 PHE A 305
LEU A 122
THR A  86
VAL A  80
THR A 301
 None
 1.47A 5v1tA-6dfpA:
undetectable		 5v1tA-6dfpA:
undetectable