SIMILAR PATTERNS OF AMINO ACIDS FOR 6FBV_D_FI8D1904_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.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE
ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis;
Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG B 229
VAL B 208
ARG A 146
GLN A  69
 None
 1.16A 6fbvD-1bplB:
0.0		 6fbvD-1bplB:
12.02
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.
1by4 PROTEIN (RETINOIC
ACID RECEPTOR
RXR-ALPHA)

(Homo sapiens) 		PF00105
(zf-C4) 		4 LYS A1181
ARG A1184
VAL A1149
ARG A1161
 None
ZN  A1330 ( 4.6A)
None
None
 1.23A 6fbvD-1by4A:
undetectable		 6fbvD-1by4A:
4.60
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.
1c8x ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE H

(Streptomyces
plicatus) 		PF00704
(Glyco_hydro_18) 		4 ASP A 189
LYS A 187
VAL A  90
GLN A 106
 ASP  A 189 ( 0.6A)
LYS  A 187 ( 0.0A)
VAL  A  90 ( 0.6A)
GLN  A 106 ( 0.6A)
 1.24A 6fbvD-1c8xA:
0.0		 6fbvD-1c8xA:
12.06
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.
1ci9 PROTEIN
(CARBOXYLESTERASE)

(Burkholderia
gladioli) 		PF00144
(Beta-lactamase) 		4 ASP A 283
ARG A 215
ARG A 226
VAL A 264
 None
 1.18A 6fbvD-1ci9A:
0.0		 6fbvD-1ci9A:
16.44
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.
1ecg GLUTAMINE
PHOSPHORIBOSYLPYROPH
OSPHATE
AMIDOTRANSFERASE

(Escherichia
coli) 		PF00156
(Pribosyltran)
PF13522
(GATase_6) 		4 ASP A 469
ARG A 164
GLU A 457
VAL A 460
 None
 1.27A 6fbvD-1ecgA:
0.0		 6fbvD-1ecgA:
19.39
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.
1ee8 MUTM (FPG) PROTEIN

(Thermus
thermophilus) 		PF01149
(Fapy_DNA_glyco)
PF06827
(zf-FPG_IleRS)
PF06831
(H2TH) 		4 ASP A  29
ARG A 100
VAL A 107
GLN A 153
 None
 1.24A 6fbvD-1ee8A:
0.0		 6fbvD-1ee8A:
13.20
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.
1evj GLUCOSE-FRUCTOSE
OXIDOREDUCTASE

(Zymomonas
mobilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ARG A 140
GLU A 347
VAL A 342
ARG A 223
 None
 1.19A 6fbvD-1evjA:
0.0		 6fbvD-1evjA:
13.93
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.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		4 ASP A 367
ARG A  50
GLU A  55
VAL A 103
 GOL  A 973 (-3.6A)
None
None
None
 0.94A 6fbvD-1fw8A:
0.0		 6fbvD-1fw8A:
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.
1lam LEUCINE
AMINOPEPTIDASE

(Bos taurus) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		4 ARG A  98
VAL A 108
ARG A 168
GLN A 164
 None
 1.22A 6fbvD-1lamA:
0.0		 6fbvD-1lamA:
17.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n97 CYP175A1

(Thermus
thermophilus) 		PF00067
(p450) 		4 ARG A 319
ARG A 339
VAL A 226
ARG A  91
 SRT  A 601 (-4.4A)
SRT  A 601 (-2.9A)
HEM  A 602 ( 4.2A)
HEM  A 602 (-3.9A)
 1.09A 6fbvD-1n97A:
1.5		 6fbvD-1n97A:
16.77
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.
1on9 METHYLMALONYL-COA
CARBOXYLTRANSFERASE
12S SUBUNIT

(Propionibacterium
freudenreichii) 		PF01039
(Carboxyl_trans) 		4 ARG A  50
VAL A 309
ARG A  96
GLN A 258
 None
 1.21A 6fbvD-1on9A:
undetectable		 6fbvD-1on9A:
17.79
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.
1qpg 3-PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		4 ASP A  23
ARG A 121
GLU A 126
VAL A 174
 3PG  A 451 (-2.8A)
3PG  A 451 (-3.1A)
None
None
 0.93A 6fbvD-1qpgA:
undetectable		 6fbvD-1qpgA:
15.83
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG A 229
VAL A 208
ARG A 146
GLN A  69
 None
 1.17A 6fbvD-1ud3A:
undetectable		 6fbvD-1ud3A:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1urh 3-MERCAPTOPYRUVATE
SULFURTRANSFERASE

(Escherichia
coli) 		PF00581
(Rhodanese) 		4 ARG A 208
VAL A  91
ARG A  35
GLN A  32
 None
 1.09A 6fbvD-1urhA:
undetectable		 6fbvD-1urhA:
12.17
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.
1v0m ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
lividans) 		PF00331
(Glyco_hydro_10) 		4 ASP A 191
ARG A 138
VAL A 174
GLN A  89
 None
 1.09A 6fbvD-1v0mA:
undetectable		 6fbvD-1v0mA:
14.29
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.
1vrq SARCOSINE OXIDASE
ALPHA SUBUNIT

(Corynebacterium
sp. U-96) 		PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF12831
(FAD_oxidored)
PF13510
(Fer2_4) 		4 ASP A 484
ARG A 487
VAL A 383
ARG A 218
 None
 1.25A 6fbvD-1vrqA:
undetectable		 6fbvD-1vrqA:
22.96
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.
1w9x ALPHA AMYLASE

(Bacillus
halmapalus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG A 234
VAL A 213
ARG A 148
GLN A  71
 AC1  A1492 (-3.3A)
None
None
None
 1.21A 6fbvD-1w9xA:
undetectable		 6fbvD-1w9xA:
16.60
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.
1zq1 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT E

(Pyrococcus
abyssi) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N)
PF02938
(GAD) 		4 ARG C 340
VAL C 380
ARG C 331
GLN C 328
 None
 0.99A 6fbvD-1zq1C:
0.5		 6fbvD-1zq1C:
21.52
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.
2d3l GLUCAN
1,4-ALPHA-MALTOHEXAO
SIDASE

(Bacillus sp.
707) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG A 234
VAL A 213
ARG A 148
GLN A  71
 None
 1.19A 6fbvD-2d3lA:
undetectable		 6fbvD-2d3lA:
17.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2die AMYLASE

(Bacillus sp.
(in: Bacteria)) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG A 234
VAL A 213
ARG A 148
GLN A  71
 None
 1.19A 6fbvD-2dieA:
undetectable		 6fbvD-2dieA:
15.96
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.
2dpp NITRILE HYDRATASE
ALPHA SUBUNIT
NITRILE HYDRATASE
BETA SUBUNIT

(Bacillus sp.
RAPc8;
Bacillus sp.
RAPc8) 		PF02979
(NHase_alpha)
PF02211
(NHase_beta) 		4 ARG A 140
VAL A 104
ARG A 148
GLN B 211
 None
 1.26A 6fbvD-2dppA:
undetectable		 6fbvD-2dppA:
9.92
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF01571
(GCV_T)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4) 		4 ASP A 485
ARG A 488
VAL A 384
ARG A 219
 None
 1.25A 6fbvD-2gahA:
undetectable		 6fbvD-2gahA:
23.15
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.
2pbg 6-PHOSPHO-BETA-D-GAL
ACTOSIDASE

(Lactococcus
lactis) 		PF00232
(Glyco_hydro_1) 		4 ARG A 333
VAL A 185
ARG A 360
GLN A 357
 None
 1.28A 6fbvD-2pbgA:
0.0		 6fbvD-2pbgA:
17.23
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.
2pi5 DNA-DIRECTED RNA
POLYMERASE

(Escherichia
virus T7) 		PF00940
(RNA_pol)
PF14700
(RPOL_N) 		4 ASP A 421
ARG A 425
ARG A 792
VAL A 311
 None
 1.18A 6fbvD-2pi5A:
undetectable		 6fbvD-2pi5A:
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 ASP A 736
ARG A 709
VAL A 721
ARG A 805
 None
 1.24A 6fbvD-2qo3A:
undetectable		 6fbvD-2qo3A:
24.17
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.
2rha TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Novosphingobium
aromaticivorans) 		PF14514
(TetR_C_9) 		4 ASP A 187
ARG A  29
GLU A  30
ARG A  69
 SO4  A 218 (-4.0A)
SO4  A 218 ( 2.9A)
GOL  A 224 (-2.7A)
None
 1.20A 6fbvD-2rhaA:
undetectable		 6fbvD-2rhaA:
9.49
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.
2z7x TOLL-LIKE RECEPTOR
2, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Homo sapiens) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 ASP A 419
ARG A 395
LYS A 422
VAL A 451
 NAG  A 921 ( 3.9A)
None
None
None
 1.04A 6fbvD-2z7xA:
undetectable		 6fbvD-2z7xA:
16.49
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.
3b02 TRANSCRIPTIONAL
REGULATOR, CRP
FAMILY

(Thermus
thermophilus) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 ASP A  36
GLU A 143
VAL A 156
ARG A   6
 None
 1.19A 6fbvD-3b02A:
0.0		 6fbvD-3b02A:
10.05
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.
3cmn PUTATIVE HYDROLASE

(Chloroflexus
aurantiacus) 		PF10103
(Zincin_2) 		4 GLU A 107
VAL A 185
ARG A  50
GLN A  51
 None
 1.13A 6fbvD-3cmnA:
2.7		 6fbvD-3cmnA:
13.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cnh HYDROLASE FAMILY
PROTEIN

(Deinococcus
radiodurans) 		PF13419
(HAD_2) 		4 ARG A 190
VAL A 181
ARG A 100
GLN A  99
 None
 1.28A 6fbvD-3cnhA:
undetectable		 6fbvD-3cnhA:
9.66
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.
3cny INOSITOL CATABOLISM
PROTEIN IOLE

(Lactobacillus
plantarum) 		PF01261
(AP_endonuc_2) 		4 ASP A  21
ARG A  19
GLU A 272
GLN A  45
 None
 0.98A 6fbvD-3cnyA:
undetectable		 6fbvD-3cnyA:
13.48
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.
3e2s PROLINE
DEHYDROGENASE

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		4 ARG A 336
GLU A 289
VAL A 554
GLN A 407
 None
 1.01A 6fbvD-3e2sA:
0.0		 6fbvD-3e2sA:
18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e59 PYOVERDINE
BIOSYNTHESIS PROTEIN
PVCA

(Pseudomonas
aeruginosa) 		PF05141
(DIT1_PvcA) 		4 ARG A 136
GLU A  84
VAL A  75
ARG A  22
 None
 1.16A 6fbvD-3e59A:
undetectable		 6fbvD-3e59A:
14.55
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.
3g4e REGUCALCIN

(Homo sapiens) 		PF08450
(SGL) 		4 LYS A 198
GLU A 200
VAL A 216
GLN A 275
 None
 1.18A 6fbvD-3g4eA:
undetectable		 6fbvD-3g4eA:
13.38
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.
3gsz RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		4 ASP A  61
ARG A 345
VAL A  71
ARG A 280
 None
 1.12A 6fbvD-3gszA:
undetectable		 6fbvD-3gszA:
19.38
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.
3hc7 GENE 12 PROTEIN

(Mycobacterium
virus D29) 		PF01083
(Cutinase) 		4 ASP A 160
ARG A 121
VAL A  57
GLN A 203
 None
 0.93A 6fbvD-3hc7A:
undetectable		 6fbvD-3hc7A:
11.20
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.
3hrd NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE
FAD-SUBUNIT

(Eubacterium
barkeri;
Eubacterium
barkeri) 		PF02738
(Ald_Xan_dh_C2)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		4 ASP B 264
ARG C 191
LYS C 190
GLU B 199
 None
 1.26A 6fbvD-3hrdB:
undetectable		 6fbvD-3hrdB:
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.
3mjf PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Yersinia pestis) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		4 ASP A 191
ARG A 422
VAL A 239
GLN A 398
 None
GOL  A 501 (-3.8A)
None
GOL  A 502 (-3.5A)
 1.24A 6fbvD-3mjfA:
undetectable		 6fbvD-3mjfA:
15.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nap CAPSID PROTEIN
CAPSID PROTEIN
CAPSID PROTEIN

(Triatoma virus;
Triatoma virus;
Triatoma virus) 		PF08762
(CRPV_capsid)
PF00073
(Rhv)
PF00073
(Rhv) 		4 ASP C 255
VAL A   1
ARG C 126
GLN B 182
 None
 1.23A 6fbvD-3napC:
undetectable		 6fbvD-3napC:
12.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qgh RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		4 ASP A  61
ARG A 345
VAL A  71
ARG A 280
 None
 1.09A 6fbvD-3qghA:
undetectable		 6fbvD-3qghA:
18.45
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.
3qwx CELL DEATH
ABNORMALITY PROTEIN
2

(Caenorhabditis
elegans) 		PF00017
(SH2)
PF00018
(SH3_1) 		4 ARG X  45
GLU X  48
VAL X  82
ARG X  41
 None
None
None
SO4  X 175 (-3.1A)
 1.29A 6fbvD-3qwxX:
undetectable		 6fbvD-3qwxX:
8.97
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.
3qxf ENDOGLUCANASE

(Escherichia
coli) 		PF01270
(Glyco_hydro_8) 		4 LYS A  24
ARG A 347
VAL A 321
ARG A 349
 None
 1.28A 6fbvD-3qxfA:
undetectable		 6fbvD-3qxfA:
13.05
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.
3shp PUTATIVE
ACETYLTRANSFERASE
STHE_0691

(Sphaerobacter
thermophilus) 		no annotation 4 ASP A  94
ARG A 129
ARG A  99
ARG A  38
 None
 1.26A 6fbvD-3shpA:
undetectable		 6fbvD-3shpA:
8.51
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.
3sm9 METABOTROPIC
GLUTAMATE RECEPTOR 3

(Homo sapiens) 		PF01094
(ANF_receptor) 		4 ASP A 276
ARG A  39
GLU A 362
VAL A 368
 Z99  A 485 ( 3.8A)
Z99  A 485 (-3.8A)
None
None
 1.27A 6fbvD-3sm9A:
0.0		 6fbvD-3sm9A:
16.18
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.
3t1i DOUBLE-STRAND BREAK
REPAIR PROTEIN
MRE11A

(Homo sapiens) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		4 ASP A 136
ARG A 155
VAL A 150
GLN A 218
 None
 1.08A 6fbvD-3t1iA:
0.0		 6fbvD-3t1iA:
16.21
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.
3t8l ADENINE DEAMINASE 2

(Agrobacterium
fabrum) 		PF01979
(Amidohydro_1)
PF13382
(Adenine_deam_C) 		4 ASP A 289
GLU A  96
VAL A 133
ARG A 448
 UNX  A 608 ( 2.4A)
None
None
None
 1.16A 6fbvD-3t8lA:
undetectable		 6fbvD-3t8lA:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3taw HYPOTHETICAL
GLYCOSIDE HYDROLASE

(Parabacteroides
distasonis) 		PF04041
(Glyco_hydro_130) 		4 LYS A  63
GLU A  76
ARG A 109
GLN A 104
 None
 1.07A 6fbvD-3tawA:
undetectable		 6fbvD-3tawA:
12.78
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.
3v71 PUF (PUMILIO/FBF)
DOMAIN-CONTAINING
PROTEIN 7, CONFIRMED
BY TRANSCRIPT
EVIDENCE

(Caenorhabditis
elegans) 		PF00806
(PUF) 		4 ARG A 140
ARG A 181
VAL A 150
GLN A 221
 None
 1.16A 6fbvD-3v71A:
2.8		 6fbvD-3v71A:
15.17
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.
3wxr PROTEASOME SUBUNIT
BETA TYPE-4
PROTEASOME SUBUNIT
BETA TYPE-5

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF00227
(Proteasome) 		4 ASP L 125
ARG L   7
LYS L 123
GLN K  60
 None
 1.29A 6fbvD-3wxrL:
0.5		 6fbvD-3wxrL:
13.05
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.
3zm8 GH26
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF02156
(Glyco_hydro_26)
PF16990
(CBM_35) 		4 GLU A 375
VAL A 361
ARG A 133
GLN A 404
 None
 1.14A 6fbvD-3zm8A:
undetectable		 6fbvD-3zm8A:
16.60
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.
3zqj UVRABC SYSTEM
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00005
(ABC_tran) 		4 ASP A 200
ARG A 250
VAL A 205
GLN A 131
 None
 1.18A 6fbvD-3zqjA:
2.2		 6fbvD-3zqjA:
23.21
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.
3zx1 OXIDOREDUCTASE,
PUTATIVE

(Campylobacter
jejuni) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASP A 150
ARG A 491
GLU A 501
VAL A 191
 None
None
OXY  A 605 ( 4.3A)
None
 1.14A 6fbvD-3zx1A:
undetectable		 6fbvD-3zx1A:
16.93
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.
4cca SYNTAXIN-BINDING
PROTEIN 2

(Homo sapiens) 		PF00995
(Sec1) 		4 GLU A 562
VAL A   9
ARG A 292
GLN A 250
 None
 1.12A 6fbvD-4ccaA:
undetectable		 6fbvD-4ccaA:
18.78
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.
4d8m PESTICIDAL CRYSTAL
PROTEIN CRY5BA

(Bacillus
thuringiensis) 		PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		4 ARG A 428
GLU A 397
VAL A 537
GLN A 602
 None
 1.01A 6fbvD-4d8mA:
2.6		 6fbvD-4d8mA:
17.77
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.
4ds2 UBIQUITIN-CONJUGATIN
G ENZYME E2,
PUTATIVE

(Trypanosoma
cruzi) 		PF00179
(UQ_con) 		4 ASP A 137
ARG A 135
ARG A 144
GLN A 152
 None
 0.86A 6fbvD-4ds2A:
undetectable		 6fbvD-4ds2A:
8.58
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 ARG B1648
VAL B1617
ARG B 603
GLN B 607
 None
 1.23A 6fbvD-4f92B:
undetectable		 6fbvD-4f92B:
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.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ASP A 221
GLU A 792
VAL A 796
GLN A 860
 NAG  A 908 (-4.9A)
None
None
None
 1.18A 6fbvD-4iigA:
undetectable		 6fbvD-4iigA:
20.44
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.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		4 ASP A  79
ARG A  90
GLU A  98
ARG A 132
 None
 1.26A 6fbvD-4ixuA:
undetectable		 6fbvD-4ixuA:
12.93
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.
4jeu SYNTAXIN-BINDING
PROTEIN 1

(Rattus
norvegicus) 		PF00995
(Sec1) 		4 GLU A 564
VAL A   9
ARG A 292
GLN A 250
 None
 1.28A 6fbvD-4jeuA:
undetectable		 6fbvD-4jeuA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l69 RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E

(Mycobacterium
tuberculosis) 		PF04452
(Methyltrans_RNA) 		4 ASP A  44
ARG A  48
VAL A 134
ARG A 246
 None
 1.14A 6fbvD-4l69A:
undetectable		 6fbvD-4l69A:
13.38
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.
4n4g ZINC FINGER MYND
DOMAIN-CONTAINING
PROTEIN 11

(Mus musculus) 		PF00439
(Bromodomain)
PF00855
(PWWP) 		4 ARG A 309
LYS A 297
VAL A 332
ARG A 358
 None
 1.10A 6fbvD-4n4gA:
undetectable		 6fbvD-4n4gA:
11.05
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.
4n78 CYTOPLASMIC
FMR1-INTERACTING
PROTEIN 1

(Homo sapiens) 		PF05994
(FragX_IP)
PF07159
(DUF1394) 		4 ARG A 597
ARG A 563
VAL A 518
GLN A  62
 None
 1.14A 6fbvD-4n78A:
undetectable		 6fbvD-4n78A:
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.
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		4 ARG A 336
GLU A 289
VAL A 554
GLN A 407
 None
 0.99A 6fbvD-4o8aA:
undetectable		 6fbvD-4o8aA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o9x TCDB2, TCCC3

(Photorhabdus
luminescens) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 ASP A1686
ARG A2013
VAL A1702
GLN A2065
 None
 1.08A 6fbvD-4o9xA:
undetectable		 6fbvD-4o9xA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4omb PHOSPHATE BINDING
PROTEIN

(Pseudomonas
aeruginosa) 		PF12849
(PBP_like_2) 		4 LYS A 100
ARG A  97
VAL A 271
ARG A 181
 None
None
None
PO4  A 401 (-2.8A)
 1.27A 6fbvD-4ombA:
undetectable		 6fbvD-4ombA:
12.88
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.
4p3m SERINE
HYDROXYMETHYLTRANSFE
RASE

(Psychromonas
ingrahamii) 		PF00464
(SHMT) 		4 ASP A 395
ARG A 305
VAL A 321
GLN A 377
 None
 0.86A 6fbvD-4p3mA:
undetectable		 6fbvD-4p3mA:
15.91
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.
4pf1 PEPTIDASE
S15/COCE/NOND

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 ASP A 497
ARG A 533
VAL A 607
GLN A 484
 None
 1.29A 6fbvD-4pf1A:
undetectable		 6fbvD-4pf1A:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rvw ZNUD

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ASP A 133
ARG A 328
GLU A 360
VAL A 410
 None
ZN  A 802 ( 4.8A)
None
None
 1.15A 6fbvD-4rvwA:
undetectable		 6fbvD-4rvwA:
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.
4rz9 PRE-MRNA-SPLICING
FACTOR 38A

(Homo sapiens) 		PF03371
(PRP38) 		4 ASP A 126
ARG A 128
LYS A  97
VAL A 157
 None
 1.22A 6fbvD-4rz9A:
undetectable		 6fbvD-4rz9A:
9.05
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.
4uzu ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 ARG A 230
VAL A 209
ARG A 147
GLN A  70
 NA  A1490 ( 4.1A)
None
None
None
 1.16A 6fbvD-4uzuA:
undetectable		 6fbvD-4uzuA:
17.66
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.
4wr3 ALANINE RACEMASE,
BIOSYNTHETIC

(Escherichia
coli) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 ARG A  59
GLU A  62
VAL A  32
GLN A 104
 None
None
PLP  A1001 ( 4.6A)
None
 1.13A 6fbvD-4wr3A:
undetectable		 6fbvD-4wr3A:
13.80
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.
4xeh KETOL-ACID
REDUCTOISOMERASE

(Ignisphaera
aggregans) 		PF01450
(IlvC)
PF07991
(IlvN) 		4 ASP A  38
ARG A  37
VAL A 147
GLN A  86
 None
 1.26A 6fbvD-4xehA:
undetectable		 6fbvD-4xehA:
13.74
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.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN

(Photobacterium
profundum) 		PF00759
(Glyco_hydro_9) 		4 ASP A 303
VAL A 427
ARG A 552
GLN A 549
 None
 1.19A 6fbvD-5dgqA:
undetectable		 6fbvD-5dgqA:
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.
5elh RING FINGER PROTEIN
UNKEMPT HOMOLOG

(Mus musculus) 		no annotation 4 ASP A 104
ARG A  72
GLU A  43
GLN A  32
 None
 1.01A 6fbvD-5elhA:
undetectable		 6fbvD-5elhA:
8.38
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.
5foe GDP-FUCOSE PROTEIN
O-FUCOSYLTRANSFERASE
2,THROMBOSPONDIN-1

(Caenorhabditis
elegans;
Homo sapiens) 		PF00090
(TSP_1)
PF10250
(O-FucT) 		4 ARG A 216
ARG A  57
VAL A  96
GLN A 367
 None
 1.16A 6fbvD-5foeA:
undetectable		 6fbvD-5foeA:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fyr PHOSPHOINOSITOL-SPEC
IFIC PHOSPHOLIPASE C

(Pseudomonas sp.) 		PF16670
(PI-PLC-C1) 		4 ASP A  50
ARG A 260
VAL A  44
GLN A 275
 CA  A 401 (-2.2A)
INS  A 301 (-2.9A)
None
None
 1.05A 6fbvD-5fyrA:
undetectable		 6fbvD-5fyrA:
12.39
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.
5jho ELECTRONEUTRAL
SODIUM BICARBONATE
EXCHANGER 1

(Homo sapiens) 		PF07565
(Band_3_cyto) 		4 ASP A  92
ARG A 305
GLU A  66
VAL A 280
 None
 1.17A 6fbvD-5jhoA:
undetectable		 6fbvD-5jhoA:
15.24
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.
5jzd ISOCHORISMATE
SYNTHASE ENTC

(Escherichia
coli) 		PF00425
(Chorismate_bind) 		4 ASP A 187
ARG A 352
VAL A 331
GLN A 174
 None
 1.09A 6fbvD-5jzdA:
undetectable		 6fbvD-5jzdA:
15.83
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.
5m4a NEUTRAL TREHALASE

(Saccharomyces
cerevisiae) 		no annotation 4 ASP A 478
ARG A 473
VAL A 709
ARG A 199
 TRE  A 801 (-2.8A)
TRE  A 801 (-4.2A)
None
None
 1.09A 6fbvD-5m4aA:
undetectable		 6fbvD-5m4aA:
18.43
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.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 4 ARG A 450
GLU A 412
VAL A 376
ARG A 469
 PRO  A 504 (-3.7A)
MN  A 499 (-2.8A)
None
None
 1.03A 6fbvD-5mc5A:
undetectable		 6fbvD-5mc5A:
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.
5mqo NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bacteroides
thetaiotaomicron) 		PF07944
(Glyco_hydro_127) 		4 ASP A 222
VAL A 133
ARG A 464
GLN A 468
 None
 1.21A 6fbvD-5mqoA:
undetectable		 6fbvD-5mqoA:
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 ARG A 551
GLU A 548
VAL A 794
ARG A 625
 None
 1.14A 6fbvD-5nd1A:
undetectable		 6fbvD-5nd1A:
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.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 4 ARG A 787
GLU A 792
ARG A 865
GLN A1103
 None
 1.22A 6fbvD-5ngyA:
undetectable		 6fbvD-5ngyA:
21.43
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.
5o6k POLYPHOSPHATE:AMP
PHOSPHOTRANSFERASE

(Meiothermus
ruber) 		no annotation 4 ASP A 196
ARG A 122
GLU A 126
VAL A 131
 None
 1.28A 6fbvD-5o6kA:
undetectable		 6fbvD-5o6kA:
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.
5odr METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
G
METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
A

(Methanothermococcus
thermolithotrophicus;
Methanothermococcus
thermolithotrophicus) 		PF01058
(Oxidored_q6)
PF00374
(NiFeSe_Hases) 		4 ASP E 279
VAL F 363
ARG F  92
GLN F 172
 None
 1.17A 6fbvD-5odrE:
undetectable		 6fbvD-5odrE:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5okl AFAMIN

(Homo sapiens) 		no annotation 4 ASP A 455
ARG A 486
GLU A 460
ARG A 524
 None
 1.26A 6fbvD-5oklA:
undetectable		 6fbvD-5oklA:
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.
5u1d ANTIGEN PEPTIDE
TRANSPORTER 1
ANTIGEN PEPTIDE
TRANSPORTER 2
TAP TRANSPORTER
INHIBITOR ICP47

(Homo sapiens;
Homo sapiens;
Human
alphaherpesvirus
1) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF05363
(Herpes_US12) 		4 ASP A 297
GLU X  28
VAL A 460
GLN B 424
 None
 1.21A 6fbvD-5u1dA:
undetectable		 6fbvD-5u1dA:
21.65
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.
5u2o J30 CCH

(Thermobacillus
composti) 		no annotation 4 ASP A  53
LYS A   7
VAL A 389
ARG A 538
 None
 1.26A 6fbvD-5u2oA:
undetectable		 6fbvD-5u2oA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uhe DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA'

(Mycobacterium
tuberculosis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 ASP D  57
ARG D  84
GLU D 323
VAL D 328
 None
 1.09A 6fbvD-5uheD:
undetectable		 6fbvD-5uheD:
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.
5vtm TYPE II SECRETION
SYSTEM PROTEIN J
TYPE II SECRETION
SYSTEM PROTEIN K

(Pseudomonas
aeruginosa;
Pseudomonas
aeruginosa) 		no annotation
no annotation 		4 ARG X 192
VAL W  69
ARG W 122
GLN W 139
 None
 1.21A 6fbvD-5vtmX:
undetectable		 6fbvD-5vtmX:
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 4 ASP A 703
LYS A 706
GLU A 708
ARG A 681
 None
None
None
A  B   8 ( 4.3A)
 1.25A 6fbvD-5wlhA:
undetectable		 6fbvD-5wlhA:
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.
5wrp PYRUVATE KINASE

(Mycobacterium
tuberculosis) 		no annotation 4 ASP A 115
ARG A 111
ARG A 194
GLU A 223
 None
 1.23A 6fbvD-5wrpA:
undetectable		 6fbvD-5wrpA:
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.
5x2g CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Campylobacter
jejuni) 		no annotation 4 ARG A  52
ARG A  60
ARG A 129
GLN A 197
 C  B  15 ( 3.5A)
U  B  16 ( 2.8A)
G  B  18 ( 3.8A)
None
 1.09A 6fbvD-5x2gA:
undetectable		 6fbvD-5x2gA:
21.38
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.
5xbl CRISPR-ASSOCIATED
ENDONUCLEASE
CAS9/CSN1

(Streptococcus
pyogenes) 		PF13395
(HNH_4)
PF16592
(Cas9_REC)
PF16593
(Cas9-BH)
PF16595
(Cas9_PI) 		4 ARG A  66
ARG A  74
VAL A 482
ARG A 165
 G  B  14 ( 3.7A)
U  B  16 ( 2.3A)
None
G  B  18 ( 3.9A)
 1.08A 6fbvD-5xblA:
undetectable		 6fbvD-5xblA:
23.52
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.
5y6r GENOME POLYPROTEIN

(Pestivirus C) 		no annotation 4 LYS A 282
ARG A 267
GLU A 265
ARG A 517
 None
SO4  A 721 (-4.4A)
SO4  A 721 ( 4.8A)
SO4  A 720 (-3.1A)
 1.07A 6fbvD-5y6rA:
undetectable		 6fbvD-5y6rA:
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.
6bm7 INACTIVE
S-ADENOSYLMETHIONINE
DECARBOXYLASE
PROZYME

(Trypanosoma
brucei) 		no annotation 4 ARG E  86
ARG E 235
VAL E 205
GLN E 197
 None
None
None
PUT  E 401 ( 4.6A)
 1.25A 6fbvD-6bm7E:
undetectable		 6fbvD-6bm7E:
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.
6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA

(Homo sapiens) 		no annotation 4 ARG C 172
ARG C  36
GLU C 145
GLN C  44
 None
 1.24A 6fbvD-6cajC:
undetectable		 6fbvD-6cajC:
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.
6em0 2-HYDROXYBIPHENYL-3-
MONOOXYGENASE

(Pseudomonas
nitroreducens) 		no annotation 4 ARG A 139
VAL A 184
ARG A  46
GLN A 120
 None
None
FAD  A 601 (-3.5A)
FAD  A 601 (-3.2A)
 1.16A 6fbvD-6em0A:
undetectable		 6fbvD-6em0A:
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.
6f5d ATP SYNTHASE GAMMA
SUBUNIT
ATP SYNTHASE DELTA
SUBUNIT

(Trypanosoma
brucei;
Trypanosoma
brucei) 		no annotation
no annotation 		4 GLU H  12
VAL G 173
ARG G 198
GLN G 195
 None
 1.21A 6fbvD-6f5dH:
undetectable		 6fbvD-6f5dH:
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.
6gbc MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN
CNX1

(Arabidopsis
thaliana) 		no annotation 4 ARG A  24
GLU A  21
VAL A 291
GLN A 343
 None
 1.19A 6fbvD-6gbcA:
undetectable		 6fbvD-6gbcA:
undetectable