SIMILAR PATTERNS OF AMINO ACIDS FOR 5KPC_A_SAMA401_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a8p NADPH:FERREDOXIN
OXIDOREDUCTASE

(Azotobacter
vinelandii) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 PHE A 185
SER A 184
ASN A  16
ASP A  17
 None
 1.43A 5kpcA-1a8pA:
3.5		 5kpcA-1a8pA:
20.54
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.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		4 PHE A 209
SER A 208
ASN A 278
ASP A 280
 None
None
FAD  A 399 (-2.7A)
FAD  A 399 (-4.8A)
 1.38A 5kpcA-1efpA:
1.6		 5kpcA-1efpA:
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.
1h8l CARBOXYPEPTIDASE
GP180 RESIDUES
503-882

(Lophonetta
specularioides) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		4 SER A 202
ASN A 144
GLN A 257
ASP A 142
 None
GEM  A 801 (-4.0A)
None
None
 1.31A 5kpcA-1h8lA:
0.2		 5kpcA-1h8lA:
20.81
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.
1iid PEPTIDE
N-MYRISTOYLTRANSFERA
SE

(Saccharomyces
cerevisiae) 		PF01233
(NMT)
PF02799
(NMT_C) 		4 PHE A 329
SER A 313
ASN A 404
ASP A 403
 None
 1.34A 5kpcA-1iidA:
0.1		 5kpcA-1iidA:
20.96
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.
1naa CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 SER A 562
ASN A 517
GLN A 582
ASP A 516
 ABL  A 901 ( 4.2A)
None
None
None
 1.25A 5kpcA-1naaA:
2.0		 5kpcA-1naaA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qil TOXIC SHOCK SYNDROME
TOXIN-1

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C) 		4 PHE A  47
SER A  32
ASN A  37
GLN A  84
 None
 1.39A 5kpcA-1qilA:
0.0		 5kpcA-1qilA:
18.23
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.
1ukc ESTA

(Aspergillus
niger) 		PF00135
(COesterase) 		4 PHE A 240
SER A 239
ASN A 177
ASP A 308
 EDO  A1902 ( 4.5A)
None
None
None
 1.25A 5kpcA-1ukcA:
1.0		 5kpcA-1ukcA:
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.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN

(Aquifex
aeolicus) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 SER A 299
ASN A 219
GLN A 324
ASP A 215
 None
 1.38A 5kpcA-1ulzA:
2.3		 5kpcA-1ulzA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1us2 ENDO-BETA-1,4-XYLANA
SE

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10)
PF03426
(CBM_15) 		4 PHE A 289
SER A 550
ASN A 267
ASP A 269
 None
 1.50A 5kpcA-1us2A:
0.4		 5kpcA-1us2A:
19.75
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.
1uwy CARBOXYPEPTIDASE M

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		4 SER A 197
ASN A 136
GLN A 249
ASP A 134
 None
 1.41A 5kpcA-1uwyA:
undetectable		 5kpcA-1uwyA:
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.
1uwy CARBOXYPEPTIDASE M

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		4 SER A 240
ASN A 136
GLN A 249
ASP A 134
 None
 1.45A 5kpcA-1uwyA:
undetectable		 5kpcA-1uwyA:
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.
1v6y ENDO-1,4-BETA-D-XYLA
NASE AND
ENDO-1,4-BETA-XYLANA
SE B

(Cellulomonas
fimi;
Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10) 		4 PHE A 130
SER A 131
ASN A 220
ASP A 216
 None
 1.40A 5kpcA-1v6yA:
undetectable		 5kpcA-1v6yA:
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.
1w3f HEMOLYTIC LECTIN
FROM LAETIPORUS
SULPHUREUS

(Laetiporus
sulphureus) 		PF03318
(ETX_MTX2) 		4 PHE A  48
SER A  49
ASN A  28
GLN A  84
 None
 1.35A 5kpcA-1w3fA:
undetectable		 5kpcA-1w3fA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2boa CARBOXYPEPTIDASE A4

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 PHE A  37
SER A  40
ASN A1159
ASP A1158
 None
 1.32A 5kpcA-2boaA:
undetectable		 5kpcA-2boaA:
19.16
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		4 SER A 344
ASN A  33
GLN A 264
ASP A  29
 None
 1.48A 5kpcA-2gljA:
undetectable		 5kpcA-2gljA:
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.
2isa CATALASE

(Aliivibrio
salmonicida) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 PHE A  92
SER A  93
ASN A 223
ASP A 181
 None
HEM  A 486 ( 4.4A)
None
None
 1.45A 5kpcA-2isaA:
undetectable		 5kpcA-2isaA:
19.80
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.
2nv9 A207R PROTEIN,
ARGININE
DECARBOXYLASE

(Paramecium
bursaria
Chlorella virus
1) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 PHE A 290
SER A 285
ASN A  50
ASP A  52
 None
 1.02A 5kpcA-2nv9A:
undetectable		 5kpcA-2nv9A:
23.23
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.
2obe HEXON

(Human
mastadenovirus
E) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 PHE A 112
SER A 111
ASN A 520
ASP A 373
 None
 1.38A 5kpcA-2obeA:
undetectable		 5kpcA-2obeA:
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		4 PHE A 553
SER A 603
GLN A 502
ASP A 542
 None
 1.32A 5kpcA-2vz9A:
undetectable		 5kpcA-2vz9A:
9.87
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.
2zws NEUTRAL CERAMIDASE

(Pseudomonas
aeruginosa) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		4 PHE A 187
SER A 186
GLN A 142
ASP A   2
 None
GOL  A 668 ( 4.9A)
None
None
 1.50A 5kpcA-2zwsA:
undetectable		 5kpcA-2zwsA:
19.36
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.
3bwt PROTEIN PUF4

(Saccharomyces
cerevisiae) 		PF00806
(PUF) 		4 PHE A 702
ASN A 740
GLN A 703
ASP A 743
 None
 1.45A 5kpcA-3bwtA:
undetectable		 5kpcA-3bwtA:
23.06
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.
3d6n DIHYDROOROTASE

(Aquifex
aeolicus) 		PF01979
(Amidohydro_1) 		4 SER A  77
ASN A  95
GLN A  69
ASP A 153
 None
FLC  A 424 (-3.6A)
None
ZN  A 423 ( 2.4A)
 1.42A 5kpcA-3d6nA:
undetectable		 5kpcA-3d6nA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gem SHORT CHAIN
DEHYDROGENASE

(Pseudomonas
savastanoi) 		PF13561
(adh_short_C2) 		4 PHE A  58
SER A  59
GLN A  15
ASP A 135
 None
 1.44A 5kpcA-3gemA:
3.9		 5kpcA-3gemA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h5t TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Corynebacterium
glutamicum) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		4 PHE A  91
ASN A 173
GLN A 319
ASP A 223
 None
 0.86A 5kpcA-3h5tA:
undetectable		 5kpcA-3h5tA:
18.76
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.
3h7l ENDOGLUCANASE

(Vibrio
parahaemolyticus) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		4 PHE A 507
SER A 142
GLN A 504
ASP A 538
 None
 1.03A 5kpcA-3h7lA:
undetectable		 5kpcA-3h7lA:
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.
3ihy PHOSPHATIDYLINOSITOL
3-KINASE CATALYTIC
SUBUNIT TYPE 3

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka) 		4 SER A 369
ASN A 827
GLN A 401
ASP A 505
 None
 1.39A 5kpcA-3ihyA:
undetectable		 5kpcA-3ihyA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j9e VP5

(Bluetongue
virus) 		PF00901
(Orbi_VP5) 		4 PHE D 123
SER D 157
ASN D 108
ASP D 104
 None
 1.21A 5kpcA-3j9eD:
undetectable		 5kpcA-3j9eD:
22.37
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		4 PHE A 564
SER A 563
ASN A 361
ASP A 431
 None
None
GOL  A 643 (-3.1A)
THH  A 642 (-3.3A)
 1.33A 5kpcA-3k13A:
undetectable		 5kpcA-3k13A:
20.96
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.
3l4e UNCHARACTERIZED
PEPTIDASE LMO0363

(Listeria
monocytogenes) 		PF03575
(Peptidase_S51) 		4 PHE A  90
SER A 137
GLN A  94
ASP A  63
 None
SO4  A 207 (-4.4A)
None
None
 1.35A 5kpcA-3l4eA:
undetectable		 5kpcA-3l4eA:
23.43
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.
3la6 TYROSINE-PROTEIN
KINASE WZC

(Escherichia
coli) 		PF13614
(AAA_31) 		4 PHE A 604
SER A 600
GLN A 553
ASP A 504
 None
 1.41A 5kpcA-3la6A:
undetectable		 5kpcA-3la6A:
22.66
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.
3mbw EPHRIN TYPE-A
RECEPTOR 2

(Homo sapiens) 		PF01404
(Ephrin_lbd) 		4 PHE A 156
SER A 154
ASN A 164
ASP A 148
 None
None
None
UNX  A 327 ( 2.7A)
 1.46A 5kpcA-3mbwA:
undetectable		 5kpcA-3mbwA:
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.
3naf CALCIUM-ACTIVATED
POTASSIUM CHANNEL
SUBUNIT
ALPHA-1,CALCIUM-ACTI
VATED POTASSIUM
CHANNEL SUBUNIT
ALPHA-1,CALCIUM-ACTI
VATED POTASSIUM
CHANNEL SUBUNIT
ALPHA-1

(Homo sapiens) 		PF03493
(BK_channel_a) 		4 PHE A 359
SER A 357
ASN A 440
GLN A 459
 None
 1.29A 5kpcA-3nafA:
undetectable		 5kpcA-3nafA:
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.
3ozb METHYLTHIOADENOSINE
PHOSPHORYLASE

(Pseudomonas
aeruginosa) 		PF01048
(PNP_UDP_1) 		4 PHE A 143
SER A 144
ASN A 194
ASP A 195
 None
None
None
SO4  A 261 ( 4.5A)
 1.50A 5kpcA-3ozbA:
undetectable		 5kpcA-3ozbA:
21.55
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.
3q1n GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
paracasei) 		PF01263
(Aldose_epim) 		4 PHE A  49
SER A  51
ASN A  97
GLN A  94
 None
 1.44A 5kpcA-3q1nA:
undetectable		 5kpcA-3q1nA:
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.
3t20 CIS-ACONITATE PORIN
OPDH

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 SER A 281
ASN A 246
GLN A 208
ASP A 273
 None
 1.46A 5kpcA-3t20A:
undetectable		 5kpcA-3t20A:
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.
3wg6 CONJUGATED
POLYKETONE REDUCTASE
C1

(Candida
parapsilosis) 		PF00248
(Aldo_ket_red) 		4 PHE A 296
SER A 297
GLN A 183
ASP A  84
 NDP  A3001 (-3.7A)
None
NDP  A3001 (-3.8A)
None
 1.26A 5kpcA-3wg6A:
undetectable		 5kpcA-3wg6A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ew7 CONJUGATIVE
TRANSFER: REGULATION

(Salmonella
enterica) 		PF00989
(PAS) 		4 PHE A  74
SER A  77
ASN A  67
ASP A  58
 None
 1.29A 5kpcA-4ew7A:
undetectable		 5kpcA-4ew7A:
16.20
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.
4g25 PENTATRICOPEPTIDE
REPEAT-CONTAINING
PROTEIN AT2G32230,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF16953
(PRORP)
PF17177
(PPR_long) 		4 PHE A 161
SER A 158
GLN A 201
ASP A 170
 None
 1.19A 5kpcA-4g25A:
undetectable		 5kpcA-4g25A:
22.03
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.
4gl0 LMO0810 PROTEIN

(Listeria
monocytogenes) 		PF13416
(SBP_bac_8) 		4 PHE A 236
SER A 237
ASN A 185
ASP A 257
 PGE  A 501 (-3.5A)
None
EDO  A 507 ( 4.7A)
None
 1.47A 5kpcA-4gl0A:
undetectable		 5kpcA-4gl0A:
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.
4hwg UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Rickettsia
bellii) 		PF02350
(Epimerase_2) 		4 PHE A 265
SER A 264
GLN A 272
ASP A 281
 None
 1.34A 5kpcA-4hwgA:
undetectable		 5kpcA-4hwgA:
22.58
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.
4mc0 PUTATIVE
SESQUITERPENE
CYCLASE

(Kitasatospora
setae) 		no annotation 4 PHE A 224
SER A 225
GLN A 306
ASP A  53
 None
 1.06A 5kpcA-4mc0A:
undetectable		 5kpcA-4mc0A:
18.94
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.
4nv1 FORMYLTRANSFERASE

(Francisella
tularensis) 		no annotation 4 PHE C 146
SER C 145
GLN C 153
ASP C   9
 None
0FX  C 301 ( 4.2A)
None
None
 1.31A 5kpcA-4nv1C:
undetectable		 5kpcA-4nv1C:
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.
4ohj TOXIC SHOCK SYNDROME
TOXIN-1

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C) 		4 PHE A  87
SER A  72
ASN A  77
GLN A 124
 None
 1.37A 5kpcA-4ohjA:
undetectable		 5kpcA-4ohjA:
19.64
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.
4oro POLYMERASE PB2

(Influenza B
virus) 		PF00604
(Flu_PB2) 		4 PHE A 406
SER A 407
GLN A 437
ASP A 395
 GDP  A 501 (-4.2A)
None
None
None
 1.42A 5kpcA-4oroA:
undetectable		 5kpcA-4oroA:
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 5

(Homo sapiens) 		PF12862
(ANAPC5) 		4 PHE O 215
SER O 217
ASN O 247
ASP O 249
 None
 1.42A 5kpcA-5a31O:
undetectable		 5kpcA-5a31O:
18.35
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.
5chc DMSO REDUCTASE
FAMILY TYPE II
ENZYME,
MOLYBDOPTERIN
SUBUNIT

(Azospira oryzae) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 PHE A 773
SER A 768
ASN A 565
ASP A 563
 None
MGD  A1003 (-4.6A)
MD1  A1004 (-2.9A)
None
 1.37A 5kpcA-5chcA:
undetectable		 5kpcA-5chcA:
17.93
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.
5fda DIHYDROFOLATE
REDUCTASE

(Yersinia pestis) 		PF00186
(DHFR_1) 		4 PHE A 154
SER A 139
ASN A 148
ASP A 145
 None
 1.29A 5kpcA-5fdaA:
undetectable		 5kpcA-5fdaA:
15.36
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.
5fmg PROTEASOME SUBUNIT
ALPHA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		4 PHE C  12
SER C  13
ASN C 155
ASP C 151
 None
 1.33A 5kpcA-5fmgC:
undetectable		 5kpcA-5fmgC:
20.95
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.
5h3x FIBRONECTIN/FIBRINOG
EN BINDING PROTEIN

(Streptococcus
suis) 		PF05833
(FbpA) 		4 PHE A 263
SER A 259
GLN A 251
ASP A 205
 None
 1.32A 5kpcA-5h3xA:
undetectable		 5kpcA-5h3xA:
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.
5j7z PUTATIVE SECRETED
ENDOGLYCOSYLCERAMIDA
SE

(Rhodococcus
hoagii) 		PF00150
(Cellulase) 		4 PHE A 340
SER A 339
GLN A 317
ASP A 325
 None
BGC  A 604 ( 4.5A)
None
None
 1.38A 5kpcA-5j7zA:
undetectable		 5kpcA-5j7zA:
22.60
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.
5jzg CAPSID PROTEIN VP0

(Rhinovirus C) 		PF00073
(Rhv)
PF02226
(Pico_P1A) 		4 PHE C 129
SER C  87
GLN C 177
ASP C 133
 None
 1.46A 5kpcA-5jzgC:
undetectable		 5kpcA-5jzgC:
21.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kpg PAVINE
N-METHYLTRANSFERASE

(Thalictrum
flavum) 		PF02353
(CMAS) 		5 PHE A  96
SER A  97
ASN A 159
GLN A 163
ASP A 185
 None
SAH  A 401 (-2.5A)
SAH  A 401 (-3.4A)
SAH  A 401 (-3.5A)
SAH  A 401 (-3.5A)
 0.51A 5kpcA-5kpgA:
53.7		 5kpcA-5kpgA:
99.75
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.
5lsk PROTEIN MIS12
HOMOLOG
CENTROMERE PROTEIN C

(Homo sapiens;
Homo sapiens) 		PF05859
(Mis12)
PF15622
(CENP_C_N) 		4 PHE A  79
SER A  80
ASN P  11
GLN A  29
 None
 1.13A 5kpcA-5lskA:
undetectable		 5kpcA-5lskA:
19.25
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		4 SER A  92
ASN A 218
GLN A 159
ASP A 217
 None
 1.09A 5kpcA-5m60A:
undetectable		 5kpcA-5m60A:
19.10
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.
5oqp CONDENSIN COMPLEX
SUBUNIT 3

(Saccharomyces
cerevisiae) 		no annotation 4 SER A  88
ASN A  55
GLN A  42
ASP A  59
 None
 1.35A 5kpcA-5oqpA:
undetectable		 5kpcA-5oqpA:
18.37
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.
5t8v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF12765
(Cohesin_HEAT)
PF12830
(Nipped-B_C) 		4 PHE A1464
SER A1465
ASN A1175
ASP A1178
 None
 1.46A 5kpcA-5t8vA:
undetectable		 5kpcA-5t8vA:
13.86
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.
5txk UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE
35,UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 35

(Homo sapiens) 		no annotation 4 PHE A 513
SER A 514
ASN A 453
ASP A 895
 None
 1.33A 5kpcA-5txkA:
undetectable		 5kpcA-5txkA:
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.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		4 PHE A1090
ASN A  48
GLN A 151
ASP A  47
 None
 1.34A 5kpcA-5uakA:
undetectable		 5kpcA-5uakA:
13.54
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.
5voc ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
betaherpesvirus
5;
Human
betaherpesvirus
5) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C)
PF01801
(Cytomega_gL) 		4 PHE A 138
SER A 139
ASN B 263
ASP A 265
 None
 1.17A 5kpcA-5vocA:
undetectable		 5kpcA-5vocA:
18.87
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.
5wbl REGULATORY-ASSOCIATE
D PROTEIN OF TOR 1

(Arabidopsis
thaliana) 		no annotation 4 PHE A 140
SER A 141
ASN A 200
ASP A 244
 None
 1.28A 5kpcA-5wblA:
undetectable		 5kpcA-5wblA:
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.
5xea ENVELOPE
GLYCOPROTEIN

(Thogoto
thogotovirus) 		PF03273
(Baculo_gp64) 		4 SER A 180
ASN A 246
GLN A 258
ASP A 243
 None
 1.27A 5kpcA-5xeaA:
undetectable		 5kpcA-5xeaA:
22.24
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.
6bka NITRONATE
MONOOXYGENASE

(Cyberlindnera
mrakii) 		no annotation 4 SER A 351
ASN A 200
GLN A 190
ASP A 205
 None
None
FMN  A 401 (-3.9A)
None
 1.30A 5kpcA-6bkaA:
undetectable		 5kpcA-6bkaA:
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.
6c3p ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8

(Homo sapiens) 		no annotation 4 PHE E 613
SER E 615
ASN E 493
GLN E 416
 None
 1.41A 5kpcA-6c3pE:
undetectable		 5kpcA-6c3pE:
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.
6d8w HEMAGGLUTININ

(Influenza A
virus) 		no annotation 4 PHE A 113
SER A 112
ASN A 169
ASP A 237
 None
 1.46A 5kpcA-6d8wA:
undetectable		 5kpcA-6d8wA:
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.
6ejb XYLOSYLTRANSFERASE 1

(Homo sapiens) 		no annotation 4 PHE A 508
SER A 509
ASN A 499
ASP A 444
 None
 1.42A 5kpcA-6ejbA:
undetectable		 5kpcA-6ejbA:
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.
6f8z ALPHA-1,2-MANNOSIDAS
E, PUTATIVE

(Bacteroides
thetaiotaomicron) 		no annotation 4 PHE A  83
SER A  58
GLN A 126
ASP A 116
 None
 1.41A 5kpcA-6f8zA:
undetectable		 5kpcA-6f8zA:
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.
6fq3 E3 UBIQUITIN-PROTEIN
LIGASE TRIM71

(Danio rerio) 		no annotation 4 PHE A 552
SER A 551
ASN A 583
ASP A 557
 None
 1.42A 5kpcA-6fq3A:
undetectable		 5kpcA-6fq3A:
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.
6gkv COCLAURINE
N-METHYLTRANSFERASE

(Coptis japonica) 		no annotation 4 SER A  99
ASN A 161
GLN A 165
ASP A 187
 SAH  A 501 (-2.4A)
SAH  A 501 (-3.6A)
SAH  A 501 (-2.7A)
SAH  A 501 (-4.2A)
 0.87A 5kpcA-6gkvA:
47.8		 5kpcA-6gkvA:
undetectable