SIMILAR PATTERNS OF AMINO ACIDS FOR 6NCS_A_ACTA303_0

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.
1a25 PROTEIN KINASE C
(BETA)


(Rattus
norvegicus)
PF00168
(C2)
3 ILE A 215
THR A 214
PRO A 221
None
0.62A 6ncsA-1a25A:
undetectable
6ncsA-1a25A:
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.
1b35 PROTEIN (CRICKET
PARALYSIS VIRUS,
VP1)


(Cricket
paralysis virus)
PF08762
(CRPV_capsid)
3 ILE A 196
THR A  76
PRO A 201
None
0.59A 6ncsA-1b35A:
undetectable
6ncsA-1b35A:
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.
1bw0 PROTEIN (TYROSINE
AMINOTRANSFERASE)


(Trypanosoma
cruzi)
PF00155
(Aminotran_1_2)
3 ILE A 381
THR A 380
PRO A  18
None
0.63A 6ncsA-1bw0A:
2.4
6ncsA-1bw0A:
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.
1bwd PROTEIN
(INOSAMINE-PHOSPHATE
AMIDINOTRANSFERASE)


(Streptomyces
griseus)
no annotation 3 ILE A  17
THR A 334
PRO A  82
None
0.62A 6ncsA-1bwdA:
undetectable
6ncsA-1bwdA:
22.04
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.
1eu1 DIMETHYL SULFOXIDE
REDUCTASE


(Rhodobacter
sphaeroides)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
3 ILE A 572
THR A 573
PRO A 366
None
0.66A 6ncsA-1eu1A:
undetectable
6ncsA-1eu1A:
16.15
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.
1f20 NITRIC-OXIDE
SYNTHASE


(Rattus
norvegicus)
PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1)
3 ILE A1090
THR A1089
PRO A1055
None
0.48A 6ncsA-1f20A:
undetectable
6ncsA-1f20A:
20.80
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.
1gyd ARABINAN
ENDO-1,5-ALPHA-L-ARA
BINOSIDASE A


(Cellvibrio
japonicus)
PF04616
(Glyco_hydro_43)
3 ILE B  57
THR B  58
PRO B  96
None
0.65A 6ncsA-1gydB:
undetectable
6ncsA-1gydB:
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.
1kkh MEVALONATE KINASE

(Methanocaldococcus
jannaschii)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
3 ILE A 164
THR A 163
PRO A  11
None
0.56A 6ncsA-1kkhA:
undetectable
6ncsA-1kkhA:
23.50
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.
1qgc PROTEIN (VIRUS
CAPSID PROTEIN VP2)


(Foot-and-mouth
disease virus)
PF00073
(Rhv)
3 ILE 2 158
THR 2 159
PRO 2 144
None
0.48A 6ncsA-1qgc2:
undetectable
6ncsA-1qgc2:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli)
PF01048
(PNP_UDP_1)
PF10423
(AMNp_N)
3 ILE A 239
THR A 240
PRO A 246
None
0.48A 6ncsA-1t8wA:
undetectable
6ncsA-1t8wA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tg5 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE


(Arabidopsis
thaliana)
PF00903
(Glyoxalase)
3 ILE A 155
THR A 154
PRO A 100
None
0.58A 6ncsA-1tg5A:
undetectable
6ncsA-1tg5A:
21.40
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.
1tll NITRIC-OXIDE
SYNTHASE, BRAIN


(Rattus
norvegicus)
PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1)
3 ILE A1090
THR A1089
PRO A1055
None
0.52A 6ncsA-1tllA:
undetectable
6ncsA-1tllA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v87 DELTEX PROTEIN 2

(Mus musculus)
PF00097
(zf-C3HC4)
3 ILE A  91
THR A  90
PRO A 100
None
0.54A 6ncsA-1v87A:
undetectable
6ncsA-1v87A:
17.95
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.
1x5y MYOSIN BINDING
PROTEIN C, FAST-TYPE


(Mus musculus)
PF00041
(fn3)
3 ILE A 103
THR A 102
PRO A  74
None
0.63A 6ncsA-1x5yA:
undetectable
6ncsA-1x5yA:
18.88
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.
1zba COAT PROTEIN VP2

(Foot-and-mouth
disease virus)
PF00073
(Rhv)
3 ILE 2 158
THR 2 159
PRO 2 144
None
0.49A 6ncsA-1zba2:
undetectable
6ncsA-1zba2:
19.79
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.
2b49 PROTEIN TYROSINE
PHOSPHATASE,
NON-RECEPTOR TYPE 3


(Homo sapiens)
PF00102
(Y_phosphatase)
3 ILE A 662
THR A 663
PRO A 681
None
0.54A 6ncsA-2b49A:
undetectable
6ncsA-2b49A:
22.52
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.
2bzu FIBER PROTEIN 2

(Human
mastadenovirus
F)
PF00541
(Adeno_knob)
3 ILE A 347
THR A 348
PRO A 376
None
0.62A 6ncsA-2bzuA:
undetectable
6ncsA-2bzuA:
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.
2d2r UNDECAPRENYL
PYROPHOSPHATE
SYNTHASE


(Helicobacter
pylori)
PF01255
(Prenyltransf)
3 ILE A  40
THR A  41
PRO A 212
None
0.65A 6ncsA-2d2rA:
undetectable
6ncsA-2d2rA:
24.40
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.
2g28 PYRUVATE
DEHYDROGENASE E1
COMPONENT


(Escherichia
coli)
PF00456
(Transketolase_N)
3 ILE A 439
THR A 440
PRO A 427
None
0.54A 6ncsA-2g28A:
undetectable
6ncsA-2g28A:
14.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nsq E3 UBIQUITIN-PROTEIN
LIGASE NEDD4-LIKE
PROTEIN


(Homo sapiens)
PF00168
(C2)
3 ILE A  66
THR A  65
PRO A  72
None
0.64A 6ncsA-2nsqA:
undetectable
6ncsA-2nsqA:
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.
2odk HYPOTHETICAL PROTEIN

(Nitrosomonas
europaea)
PF02604
(PhdYeFM_antitox)
3 ILE A  21
THR A  22
PRO A  40
None
0.57A 6ncsA-2odkA:
undetectable
6ncsA-2odkA:
17.59
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.
2pnw MEMBRANE-BOUND LYTIC
MUREIN
TRANSGLYCOSYLASE


(Agrobacterium
fabrum)
PF03562
(MltA)
PF06725
(3D)
3 ILE A  50
THR A  51
PRO A 361
None
0.63A 6ncsA-2pnwA:
undetectable
6ncsA-2pnwA:
20.74
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.
2r17 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 35


(Homo sapiens)
PF03635
(Vps35)
3 ILE C 568
THR C 567
PRO C 580
None
0.58A 6ncsA-2r17C:
undetectable
6ncsA-2r17C:
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.
2rb9 HYPE PROTEIN

(Escherichia
coli)
PF00586
(AIRS)
PF02769
(AIRS_C)
3 ILE A 183
THR A 182
PRO A  64
None
0.64A 6ncsA-2rb9A:
undetectable
6ncsA-2rb9A:
23.92
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.
2vsi 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE


(Streptococcus
pneumoniae)
PF01128
(IspD)
3 ILE A 118
THR A 119
PRO A 170
None
0.60A 6ncsA-2vsiA:
3.0
6ncsA-2vsiA:
24.51
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.
2waw MOBA RELATE PROTEIN

(Mycobacterium
sp. DSM 3803)
PF12804
(NTP_transf_3)
3 ILE A 109
THR A 110
PRO A 138
None
0.60A 6ncsA-2wawA:
undetectable
6ncsA-2wawA:
19.66
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.
2wkn FORMAMIDASE

(Delftia
acidovorans)
PF03069
(FmdA_AmdA)
3 ILE A 397
THR A 398
PRO A 142
None
0.51A 6ncsA-2wknA:
undetectable
6ncsA-2wknA:
21.71
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.
2y27 PHENYLACETATE-COENZY
ME A LIGASE


(Burkholderia
cenocepacia)
PF00501
(AMP-binding)
PF14535
(AMP-binding_C_2)
3 ILE A 387
THR A 384
PRO A 376
None
0.63A 6ncsA-2y27A:
undetectable
6ncsA-2y27A:
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.
2z1u HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HYPE


(Desulfovibrio
vulgaris)
PF00586
(AIRS)
PF02769
(AIRS_C)
3 ILE A 179
THR A 178
PRO A  60
None
0.58A 6ncsA-2z1uA:
undetectable
6ncsA-2z1uA:
23.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ahi XYLULOSE
5-PHOSPHATE/FRUCTOSE
6-PHOSPHATE
PHOSPHOKETOLASE


(Bifidobacterium
breve)
PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N)
3 ILE A 270
THR A 269
PRO A 292
None
0.62A 6ncsA-3ahiA:
undetectable
6ncsA-3ahiA:
17.43
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.
3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE


(Bifidobacterium
longum)
PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N)
3 ILE A 270
THR A 269
PRO A 292
None
0.58A 6ncsA-3ai7A:
undetectable
6ncsA-3ai7A:
16.36
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.
3bib T-CELL
IMMUNOGLOBULIN AND
MUCIN
DOMAIN-CONTAINING
PROTEIN 4


(Mus musculus)
PF07686
(V-set)
3 ILE X   6
THR X   5
PRO X  17
None
0.65A 6ncsA-3bibX:
undetectable
6ncsA-3bibX:
17.12
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.
3cux MALATE SYNTHASE

(Bacillus
anthracis)
PF01274
(Malate_synthase)
3 ILE A  91
THR A  92
PRO A 367
None
0.66A 6ncsA-3cuxA:
11.9
6ncsA-3cuxA:
21.21
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.
3d02 PUTATIVE LACI-TYPE
TRANSCRIPTIONAL
REGULATOR


(Klebsiella
pneumoniae)
PF13407
(Peripla_BP_4)
3 ILE A 261
THR A 262
PRO A 225
None
0.59A 6ncsA-3d02A:
2.8
6ncsA-3d02A:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3epm THIAMINE
BIOSYNTHESIS PROTEIN
THIC


(Caulobacter
vibrioides)
PF01964
(ThiC_Rad_SAM)
PF13667
(ThiC-associated)
3 ILE A 142
THR A 143
PRO A 180
None
0.50A 6ncsA-3epmA:
15.4
6ncsA-3epmA:
19.71
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.
3fdh SUSD HOMOLOG

(Bacteroides
thetaiotaomicron)
PF12771
(SusD-like_2)
3 ILE A 412
THR A 413
PRO A 298
None
0.47A 6ncsA-3fdhA:
undetectable
6ncsA-3fdhA:
20.86
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.
3ho8 PYRUVATE CARBOXYLASE

(Staphylococcus
aureus)
PF00289
(Biotin_carb_N)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
3 ILE A 367
THR A 368
PRO A 362
None
0.62A 6ncsA-3ho8A:
5.6
6ncsA-3ho8A:
15.27
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.
3i4i 1,3-1,4-BETA-GLUCANA
SE


(uncultured
murine large
bowel bacterium
BAC 14)
PF00722
(Glyco_hydro_16)
3 ILE A  50
THR A  51
PRO A 187
None
0.55A 6ncsA-3i4iA:
undetectable
6ncsA-3i4iA:
24.28
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.
3it8 2L PROTEIN

(Tanapox virus)
no annotation 3 ILE D 213
THR D 214
PRO D 245
None
0.57A 6ncsA-3it8D:
undetectable
6ncsA-3it8D:
22.52
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.
3jzy INTERSECTIN 2

(Homo sapiens)
PF00168
(C2)
3 ILE A1580
THR A1579
PRO A1586
None
UNX  A   3 ( 3.8A)
None
0.66A 6ncsA-3jzyA:
undetectable
6ncsA-3jzyA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k0b PREDICTED
N6-ADENINE-SPECIFIC
DNA METHYLASE


(Listeria
monocytogenes)
PF01170
(UPF0020)
PF02926
(THUMP)
3 ILE A 281
THR A 282
PRO A 205
None
0.27A 6ncsA-3k0bA:
undetectable
6ncsA-3k0bA:
22.88
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.
3ksw STEROL 14-ALPHA
DEMETHYLASE


(Trypanosoma
cruzi)
PF00067
(p450)
3 ILE A 298
THR A 297
PRO A 464
None
0.55A 6ncsA-3kswA:
undetectable
6ncsA-3kswA:
21.83
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.
3kwu MUNC13-1

(Rattus
norvegicus)
PF00168
(C2)
3 ILE A 728
THR A 727
PRO A 734
None
0.62A 6ncsA-3kwuA:
undetectable
6ncsA-3kwuA:
20.07
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.
3l4d STEROL 14-ALPHA
DEMETHYLASE


(Leishmania
infantum)
PF00067
(p450)
3 ILE A 297
THR A 296
PRO A 463
None
0.57A 6ncsA-3l4dA:
undetectable
6ncsA-3l4dA:
20.83
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.
3lxq UNCHARACTERIZED
PROTEIN VP1736


(Vibrio
parahaemolyticus)
PF00884
(Sulfatase)
3 ILE A 364
THR A 363
PRO A 546
None
0.55A 6ncsA-3lxqA:
undetectable
6ncsA-3lxqA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m7f E3 UBIQUITIN-PROTEIN
LIGASE NEDD4


(Mus musculus)
PF00168
(C2)
3 ILE B 164
THR B 163
PRO B 170
None
0.58A 6ncsA-3m7fB:
undetectable
6ncsA-3m7fB:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3naw SECRETED EFFECTOR
PROTEIN


(Escherichia
coli)
PF00805
(Pentapeptide)
PF13979
(SopA_C)
PF13981
(SopA)
3 ILE A 341
THR A 333
PRO A 311
None
0.52A 6ncsA-3nawA:
undetectable
6ncsA-3nawA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8o 6-PHOSPHOFRUCTOKINAS
E SUBUNIT BETA


(Saccharomyces
cerevisiae)
PF00365
(PFK)
3 ILE B 476
THR B 477
PRO B 459
None
0.33A 6ncsA-3o8oB:
undetectable
6ncsA-3o8oB:
16.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE


(Streptococcus
mutans)
PF01180
(DHO_dh)
3 ILE A 150
THR A 147
PRO A 106
None
0.34A 6ncsA-3oixA:
6.9
6ncsA-3oixA:
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.
3q1x SERINE
ACETYLTRANSFERASE


(Entamoeba
histolytica)
PF00132
(Hexapep)
3 ILE A  56
THR A  57
PRO A  47
None
0.60A 6ncsA-3q1xA:
undetectable
6ncsA-3q1xA:
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.
3r9r PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE


(Mycobacteroides
abscessus)
PF01259
(SAICAR_synt)
3 ILE A 177
THR A 176
PRO A 138
ILE  A 177 ( 0.7A)
THR  A 176 ( 0.8A)
PRO  A 138 ( 1.1A)
0.65A 6ncsA-3r9rA:
undetectable
6ncsA-3r9rA:
19.63
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.
3rdj PROTEIN KINASE C
ALPHA TYPE


(Rattus
norvegicus)
PF00168
(C2)
3 ILE A 215
THR A 214
PRO A 221
None
0.44A 6ncsA-3rdjA:
undetectable
6ncsA-3rdjA:
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.
3re2 PREDICTED PROTEIN

(Nematostella
vectensis)
PF05053
(Menin)
3 ILE A 281
THR A 282
PRO A 295
None
0.64A 6ncsA-3re2A:
undetectable
6ncsA-3re2A:
23.28
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.
3rtx MRNA-CAPPING ENZYME

(Mus musculus)
PF01331
(mRNA_cap_enzyme)
PF03919
(mRNA_cap_C)
3 ILE A 236
THR A 237
PRO A 357
None
0.60A 6ncsA-3rtxA:
undetectable
6ncsA-3rtxA:
20.17
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.
3s47 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN


(Clostridium
beijerinckii)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 ILE A  15
THR A  16
PRO A  46
None
0.49A 6ncsA-3s47A:
4.7
6ncsA-3s47A:
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.
3s6k ACETYLGLUTAMATE
KINASE


(Xanthomonas
campestris)
PF00696
(AA_kinase)
PF04768
(NAT)
3 ILE A 137
THR A 138
PRO A 165
None
0.40A 6ncsA-3s6kA:
undetectable
6ncsA-3s6kA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sp1 CYSTEINYL-TRNA
SYNTHETASE


(Borreliella
burgdorferi)
PF01406
(tRNA-synt_1e)
3 ILE A  69
THR A  67
PRO A 215
None
0.64A 6ncsA-3sp1A:
undetectable
6ncsA-3sp1A:
20.90
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.
3sqn CONSERVED DOMAIN
PROTEIN


(Enterococcus
faecalis)
PF05043
(Mga)
3 ILE A 370
THR A 369
PRO A 373
None
0.66A 6ncsA-3sqnA:
undetectable
6ncsA-3sqnA:
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.
3sto SERINE PROTEASE
INHIBITOR


(Schistosoma
haematobium)
PF00079
(Serpin)
3 ILE A 220
THR A 221
PRO A 402
None
0.57A 6ncsA-3stoA:
undetectable
6ncsA-3stoA:
22.07
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.
3tji MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN


(Enterobacter
sp. 638)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 ILE A  13
THR A  14
PRO A  44
None
0.60A 6ncsA-3tjiA:
9.2
6ncsA-3tjiA:
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.
3uwd PHOSPHOGLYCERATE
KINASE


(Bacillus
anthracis)
PF00162
(PGK)
3 ILE A 268
THR A 269
PRO A 287
None
0.62A 6ncsA-3uwdA:
undetectable
6ncsA-3uwdA:
22.14
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.
3vay HAD-SUPERFAMILY
HYDROLASE


(Pseudomonas
syringae group
genomosp. 3)
PF13419
(HAD_2)
3 ILE A 126
THR A 127
PRO A 160
None
0.46A 6ncsA-3vayA:
undetectable
6ncsA-3vayA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x1l CMR4

(Archaeoglobus
fulgidus)
PF03787
(RAMPs)
3 ILE C 245
THR C 186
PRO C 148
None
0.62A 6ncsA-3x1lC:
undetectable
6ncsA-3x1lC:
21.83
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.
3zqj UVRABC SYSTEM
PROTEIN A


(Mycobacterium
tuberculosis)
PF00005
(ABC_tran)
3 ILE A 914
THR A 650
PRO A 934
None
0.62A 6ncsA-3zqjA:
undetectable
6ncsA-3zqjA:
16.11
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.
3zzf ACETYLGLUTAMATE
KINASE


(Saccharomyces
cerevisiae)
PF00696
(AA_kinase)
3 ILE A 193
THR A 194
PRO A 221
None
0.49A 6ncsA-3zzfA:
undetectable
6ncsA-3zzfA:
21.24
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.
4eg2 CYTIDINE DEAMINASE

(Vibrio cholerae)
PF00383
(dCMP_cyt_deam_1)
PF08211
(dCMP_cyt_deam_2)
3 ILE A 124
THR A 123
PRO A 128
None
None
URI  A 302 (-4.7A)
0.60A 6ncsA-4eg2A:
undetectable
6ncsA-4eg2A:
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.
4gis ENOLASE

(Vibrio harveyi)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 ILE A  13
THR A  14
PRO A  44
None
0.62A 6ncsA-4gisA:
9.3
6ncsA-4gisA:
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.
4gqb PROTEIN ARGININE
N-METHYLTRANSFERASE
5


(Homo sapiens)
PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C)
3 ILE A 598
THR A 597
PRO A 474
None
0.63A 6ncsA-4gqbA:
8.7
6ncsA-4gqbA:
18.14
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.
4hhr ALPHA-DIOXYGENASE

(Arabidopsis
thaliana)
PF03098
(An_peroxidase)
3 ILE A 581
THR A 580
PRO A  89
None
0.57A 6ncsA-4hhrA:
undetectable
6ncsA-4hhrA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ikn AP-3 COMPLEX SUBUNIT
MU-1


(Rattus
norvegicus)
PF00928
(Adap_comp_sub)
3 ILE A 305
THR A 304
PRO A 297
ILE  A 305 ( 0.6A)
THR  A 304 ( 0.8A)
PRO  A 297 ( 1.1A)
0.65A 6ncsA-4iknA:
undetectable
6ncsA-4iknA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rsh LIPOLYTIC PROTEIN
G-D-S-L FAMILY


(Desulfitobacterium
hafniense)
PF13472
(Lipase_GDSL_2)
3 ILE A 167
THR A 166
PRO A 157
None
0.61A 6ncsA-4rshA:
3.6
6ncsA-4rshA:
19.31
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.
4s28 PHOSPHOMETHYLPYRIMID
INE SYNTHASE,
CHLOROPLASTIC


(Arabidopsis
thaliana)
PF01964
(ThiC_Rad_SAM)
3 ILE A 174
THR A 175
PRO A 189
None
0.64A 6ncsA-4s28A:
15.1
6ncsA-4s28A:
20.14
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.
4wxp NS3-4 PROTEASE

(Hepacivirus C)
PF07652
(Flavi_DEAD)
3 ILE A 265
THR A 266
PRO A 215
None
0.45A 6ncsA-4wxpA:
undetectable
6ncsA-4wxpA:
20.17
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.
4ys8 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE


(Burkholderia
thailandensis)
PF01128
(IspD)
3 ILE A 114
THR A 115
PRO A 168
None
0.55A 6ncsA-4ys8A:
2.4
6ncsA-4ys8A:
24.35
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.
5a0z CHOLINE
TRIMETHYLAMINE LYASE


(Klebsiella
pneumoniae)
PF01228
(Gly_radical)
PF02901
(PFL-like)
3 ILE A 379
THR A 378
PRO A 860
None
0.57A 6ncsA-5a0zA:
undetectable
6ncsA-5a0zA:
16.75
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.
5a8d CARBOHYDRATE BINDING
FAMILY 6


(Ruminiclostridium
thermocellum)
PF04616
(Glyco_hydro_43)
3 ILE A  75
THR A  76
PRO A 108
None
0.44A 6ncsA-5a8dA:
undetectable
6ncsA-5a8dA:
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.
5bn4 V-TYPE ATP SYNTHASE
ALPHA CHAIN


(Nanoarchaeum
equitans)
PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N)
PF16886
(ATP-synt_ab_Xtn)
3 ILE A 164
THR A 163
PRO A  73
None
0.63A 6ncsA-5bn4A:
undetectable
6ncsA-5bn4A:
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.
5d9a POLYMERASE BASIC
PROTEIN 2


(Influenza C
virus)
PF00604
(Flu_PB2)
3 ILE C 533
THR C 532
PRO C 444
None
0.63A 6ncsA-5d9aC:
undetectable
6ncsA-5d9aC:
17.60
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.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE


(Cupriavidus
metallidurans)
PF13231
(PMT_2)
3 ILE A  75
THR A  74
PRO A  87
None
0.59A 6ncsA-5f15A:
undetectable
6ncsA-5f15A:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ftw CHEMOTAXIS PROTEIN
METHYLTRANSFERASE


(Bacillus
subtilis)
PF01739
(CheR)
PF03705
(CheR_N)
3 ILE A 179
THR A 180
PRO A 108
None
0.54A 6ncsA-5ftwA:
undetectable
6ncsA-5ftwA:
23.64
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.
5fuu HIV-1 ENVELOPE
GLYCOPROTEIN GP160


(Human
immunodeficiency
virus 1)
PF00516
(GP120)
3 ILE A 161
THR A 162
PRO A 124
None
0.61A 6ncsA-5fuuA:
undetectable
6ncsA-5fuuA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h71 ALGQ2

(Sphingomonas
sp.)
PF01547
(SBP_bac_1)
3 ILE A 319
THR A 320
PRO A 326
None
0.61A 6ncsA-5h71A:
undetectable
6ncsA-5h71A:
19.72
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.
5hpk E3 UBIQUITIN-PROTEIN
LIGASE NEDD4-LIKE


(Homo sapiens)
PF00632
(HECT)
3 ILE A 724
THR A 725
PRO A 714
None
0.59A 6ncsA-5hpkA:
undetectable
6ncsA-5hpkA:
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE


(Pseudomonas
aeruginosa)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone)
3 ILE A 859
THR A 856
PRO A 787
None
0.60A 6ncsA-5im3A:
3.4
6ncsA-5im3A:
16.51
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.
5im5 DESIGNED
KETO-HYDROXYGLUTARAT
E-ALDOLASE/KETO-DEOX
Y-PHOSPHOGLUCONATE
ALDOLASE


(Vibrionales
bacterium
SWAT-3)
no annotation 3 ILE P 203
THR P 200
PRO P 162
None
0.65A 6ncsA-5im5P:
15.0
6ncsA-5im5P:
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.
5kh1 INVASION PLASMID
ANTIGEN


(Shigella
flexneri)
PF12468
(TTSSLRR)
PF14496
(NEL)
3 ILE A  81
THR A  62
PRO A  78
None
0.60A 6ncsA-5kh1A:
undetectable
6ncsA-5kh1A:
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.
5kiq PLATELET-BINDING
GLYCOPROTEIN


(Streptococcus
sanguinis)
no annotation 3 ILE A 426
THR A 425
PRO A 377
None
0.62A 6ncsA-5kiqA:
undetectable
6ncsA-5kiqA:
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.
5kiq PLATELET-BINDING
GLYCOPROTEIN


(Streptococcus
sanguinis)
no annotation 3 ILE A 436
THR A 437
PRO A 380
None
0.58A 6ncsA-5kiqA:
undetectable
6ncsA-5kiqA:
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.
5n94 CG9323, ISOFORM A

(Drosophila
melanogaster)
no annotation 3 ILE A 251
THR A 252
PRO A 187
None
0.54A 6ncsA-5n94A:
undetectable
6ncsA-5n94A:
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.
5ner O PANASIA VP2

(Foot-and-mouth
disease virus)
PF00073
(Rhv)
3 ILE 2 158
THR 2 159
PRO 2 144
None
0.50A 6ncsA-5ner2:
undetectable
6ncsA-5ner2:
18.75
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.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1


(Saccharomyces
cerevisiae)
PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
3 ILE T 485
THR T 484
PRO T 579
None
0.64A 6ncsA-5ojsT:
undetectable
6ncsA-5ojsT:
5.93
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.
5owx GENOME POLYPROTEIN

(Foot-and-mouth
disease virus)
PF00073
(Rhv)
3 ILE 2 158
THR 2 159
PRO 2 144
None
0.57A 6ncsA-5owx2:
undetectable
6ncsA-5owx2:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5szr PROTEIN PCDHGB2

(Mus musculus)
PF00028
(Cadherin)
3 ILE A 247
THR A 248
PRO A 210
None
0.62A 6ncsA-5szrA:
undetectable
6ncsA-5szrA:
21.19
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.
5uj1 DNA TOPOISOMERASE 1

(Mycobacterium
tuberculosis)
no annotation 3 ILE A 169
THR A 166
PRO A  81
None
0.57A 6ncsA-5uj1A:
undetectable
6ncsA-5uj1A:
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.
5wdx JFH-1 NS3

(Hepacivirus C)
no annotation 3 ILE A 265
THR A 266
PRO A 215
None
0.44A 6ncsA-5wdxA:
undetectable
6ncsA-5wdxA:
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.
5wl3 ENGINEERED CHALCONE
ISOMERASE ANCR2


(unidentified)
no annotation 3 ILE A  17
THR A  16
PRO A  19
None
0.60A 6ncsA-5wl3A:
undetectable
6ncsA-5wl3A:
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.
5xmj SUCCINATE
DEHYDROGENASE
IRON-SULFUR SUBUNIT


(Desulfovibrio
gigas)
no annotation 3 ILE B  88
THR B  89
PRO B  85
None
0.64A 6ncsA-5xmjB:
undetectable
6ncsA-5xmjB:
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.
6e9p -

(-)
no annotation 3 ILE A  72
THR A  71
PRO A  32
None
ACT  A 502 (-3.8A)
None
0.64A 6ncsA-6e9pA:
16.5
6ncsA-6e9pA:
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.
6ehs HYDROGENASE-2 LARGE
CHAIN


(Escherichia
coli)
no annotation 3 ILE L   5
THR L   6
PRO L 533
None
0.60A 6ncsA-6ehsL:
undetectable
6ncsA-6ehsL:
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.
6eqn TRYPTOPHAN SYNTHASE
BETA CHAIN 2


(Sulfobacillus)
no annotation 3 ILE B 238
THR B 237
PRO B  15
None
0.45A 6ncsA-6eqnB:
undetectable
6ncsA-6eqnB:
undetectable