SIMILAR PATTERNS OF AMINO ACIDS FOR 4K36_B_SAMB504_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.
1ckm MRNA CAPPING ENZYME

(Paramecium
bursaria
Chlorella virus
1) 		PF01331
(mRNA_cap_enzyme)
PF03919
(mRNA_cap_C) 		5 TYR A 226
LEU A  46
VAL A 149
ILE A 127
LEU A  56
 None
 1.40A 4k36B-1ckmA:
undetectable		 4k36B-1ckmA:
21.08
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.
1dll TETANUS TOXIN

(Clostridium
tetani) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		5 GLN A1082
ASN A1078
LEU A1074
ILE A 976
LEU A1000
 None
 1.19A 4k36B-1dllA:
undetectable		 4k36B-1dllA:
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.
1tv8 MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A

(Staphylococcus
aureus) 		PF04055
(Radical_SAM)
PF06463
(Mob_synth_C)
PF13394
(Fer4_14) 		5 TYR A  30
CYH A  31
GLU A  76
ASN A 104
VAL A 167
 SAM  A1501 ( 4.5A)
SF4  A1401 (-2.3A)
SAM  A1501 (-4.4A)
SF4  A1401 ( 4.4A)
SAM  A1501 (-4.5A)
 0.68A 4k36B-1tv8A:
18.7		 4k36B-1tv8A:
22.17
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.
1tv8 MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A

(Staphylococcus
aureus) 		PF04055
(Radical_SAM)
PF06463
(Mob_synth_C)
PF13394
(Fer4_14) 		5 TYR A  30
GLU A  76
ASN A 104
VAL A 167
ILE A 194
 SAM  A1501 ( 4.5A)
SAM  A1501 (-4.4A)
SF4  A1401 ( 4.4A)
SAM  A1501 (-4.5A)
DTU  A1502 ( 4.7A)
 0.81A 4k36B-1tv8A:
18.7		 4k36B-1tv8A:
22.17
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.
1vyn ARGONAUTE2

(Drosophila
melanogaster) 		PF02170
(PAZ) 		5 ASN A  21
LEU A  11
ILE A 113
CYH A  99
LEU A 111
 None
 1.46A 4k36B-1vynA:
undetectable		 4k36B-1vynA:
17.85
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.
1woy METHIONYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF09334
(tRNA-synt_1g) 		5 ARG A 474
LEU A 475
VAL A 473
ILE A 450
LEU A 469
 None
 1.38A 4k36B-1woyA:
0.8		 4k36B-1woyA:
22.68
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.
2a2d N-ACETYLGALACTOSAMIN
E KINASE

(Homo sapiens) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 GLU A  49
ASN A  45
LEU A 144
ILE A 138
LEU A 150
 A2G  A 459 (-3.5A)
None
None
None
ANP  A 461 (-4.6A)
 1.22A 4k36B-2a2dA:
undetectable		 4k36B-2a2dA:
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.
2c0l PEROXISOMAL
TARGETING SIGNAL 1
RECEPTOR

(Homo sapiens) 		PF00515
(TPR_1)
PF13432
(TPR_16) 		5 ASN A 602
LEU A 609
ILE A 567
CYH A 566
LEU A 569
 None
 1.50A 4k36B-2c0lA:
0.0		 4k36B-2c0lA:
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.
2cb3 PEPTIDOGLYCAN-RECOGN
ITION PROTEIN-LE

(Drosophila
melanogaster) 		PF01510
(Amidase_2) 		5 CYH A 315
ASN A 339
LEU A 311
VAL A 203
ILE A 204
 None
 1.33A 4k36B-2cb3A:
undetectable		 4k36B-2cb3A:
20.06
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.
2ch1 3-HYDROXYKYNURENINE
TRANSAMINASE

(Anopheles
gambiae) 		PF00266
(Aminotran_5) 		5 GLU A 252
ASN A 245
LEU A 240
ILE A 216
LEU A  60
 None
 1.47A 4k36B-2ch1A:
undetectable		 4k36B-2ch1A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fon PEROXISOMAL ACYL-COA
OXIDASE 1A

(Solanum
lycopersicum) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		5 TYR A 559
CYH A 556
GLU A 537
LEU A 529
LEU A 561
 None
 1.14A 4k36B-2fonA:
undetectable		 4k36B-2fonA:
20.23
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.
2hjh NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2

(Saccharomyces
cerevisiae) 		PF02146
(SIR2)
PF04574
(DUF592) 		5 TYR A 342
VAL A 486
ILE A 461
CYH A 464
LEU A 339
 None
 0.95A 4k36B-2hjhA:
undetectable		 4k36B-2hjhA:
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.
2owy RECOMBINATION-ASSOCI
ATED PROTEIN RDGC

(Pseudomonas
aeruginosa) 		PF04381
(RdgC) 		5 CYH A 195
GLU A 218
GLN A 220
VAL A 191
LEU A 176
 None
 1.40A 4k36B-2owyA:
undetectable		 4k36B-2owyA:
22.89
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.
2q9u A-TYPE FLAVOPROTEIN

(Giardia
intestinalis) 		no annotation 5 TYR A 332
TYR A  33
GLU A  87
LEU A 204
LEU A 303
 None
None
FEO  A 701 (-2.9A)
None
None
 1.31A 4k36B-2q9uA:
undetectable		 4k36B-2q9uA:
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.
2wqq ALPHA-2,3-/2,8-SIALY
LTRANSFERASE

(Campylobacter
jejuni) 		PF06002
(CST-I) 		5 CYH A 210
GLU A  15
ASN A 214
LEU A 216
LEU A 197
 None
 1.38A 4k36B-2wqqA:
undetectable		 4k36B-2wqqA:
22.98
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.
2wzs PUTATIVE
ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		5 TYR A 361
ASN A 685
LEU A 681
ILE A 289
LEU A 286
 GOL  A 802 (-4.5A)
None
None
None
None
 1.47A 4k36B-2wzsA:
undetectable		 4k36B-2wzsA:
19.14
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.
3a8p T-LYMPHOMA INVASION
AND
METASTASIS-INDUCING
PROTEIN 2

(Mus musculus) 		PF00169
(PH) 		5 CYH A 694
TYR A 695
LEU A 588
VAL A 610
ILE A 613
 None
 1.40A 4k36B-3a8pA:
undetectable		 4k36B-3a8pA:
19.85
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.
3d4j DIPHOSPHOMEVALONATE
DECARBOXYLASE

(Homo sapiens) 		PF00288
(GHMP_kinases_N) 		5 TYR A 142
GLU A 145
VAL A 151
CYH A  82
LEU A  83
 None
 1.48A 4k36B-3d4jA:
undetectable		 4k36B-3d4jA:
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.
3f4s PUTATIVE
UNCHARACTERIZED
PROTEIN

(Wolbachia
endosymbiont of
Drosophila
melanogaster) 		PF13462
(Thioredoxin_4) 		5 TYR A  98
GLU A 102
VAL A 111
ILE A 132
LEU A  94
 None
 1.31A 4k36B-3f4sA:
undetectable		 4k36B-3f4sA:
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.
3gn6 CT0912, ORFAN
PROTEIN WITH A
FERREDOXIN-LIKE
DOMAIN REPEAT

(Chlorobaculum
tepidum) 		no annotation 5 GLU A 191
LEU A 258
VAL A 168
ILE A 257
LEU A 221
 None
 1.42A 4k36B-3gn6A:
undetectable		 4k36B-3gn6A:
20.64
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.
3gt7 SENSOR PROTEIN

(Syntrophus
aciditrophicus) 		PF00072
(Response_reg) 		5 TYR A  71
CYH A 106
LEU A  91
VAL A  63
LEU A  73
 None
 1.12A 4k36B-3gt7A:
undetectable		 4k36B-3gt7A:
20.35
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.
3iht S-ADENOSYL-L-METHION
INE METHYL
TRANSFERASE

(Ruegeria
pomeroyi) 		PF12692
(Methyltransf_17) 		5 GLN A  35
LEU A 141
VAL A 143
ILE A 169
CYH A 167
 None
 1.01A 4k36B-3ihtA:
undetectable		 4k36B-3ihtA:
16.33
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.
3plx ASPARTATE
1-DECARBOXYLASE

(Campylobacter
jejuni) 		PF02261
(Asp_decarbox) 		5 ASN B 110
LEU B  32
ILE B  28
CYH B  69
LEU B  70
 PEG  B 127 ( 4.8A)
None
None
None
PYR  B  25 ( 4.8A)
 1.36A 4k36B-3plxB:
undetectable		 4k36B-3plxB:
11.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q3h HMW1C-LIKE
GLYCOSYLTRANSFERASE

(Actinobacillus
pleuropneumoniae) 		no annotation 5 GLU A 580
ASN A 577
VAL A 461
ILE A 433
LEU A 450
 None
 1.39A 4k36B-3q3hA:
2.2		 4k36B-3q3hA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4arv PHYTASE

(Yersinia
kristensenii) 		PF00328
(His_Phos_2) 		5 GLU A 361
GLN A 358
ASN A 365
LEU A  58
LEU A  48
 None
 1.47A 4k36B-4arvA:
undetectable		 4k36B-4arvA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ayg GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		5 TYR A1041
GLU A 996
ASN A 999
LEU A1004
ILE A1022
 None
 1.43A 4k36B-4aygA:
undetectable		 4k36B-4aygA:
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.
4ga6 PUTATIVE THYMIDINE
PHOSPHORYLASE

(Thermococcus
kodakarensis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 ARG A 157
LEU A 187
ILE A 189
CYH A 230
LEU A 231
 None
 1.23A 4k36B-4ga6A:
undetectable		 4k36B-4ga6A:
24.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ggp TRANS-2-ENOYL-COA
REDUCTASE

(Treponema
denticola) 		PF07055
(Eno-Rase_FAD_bd)
PF12241
(Enoyl_reductase)
PF12242
(Eno-Rase_NADH_b) 		5 ASN A  48
LEU A 139
VAL A  51
CYH A  54
LEU A  60
 None
 1.38A 4k36B-4ggpA:
2.4		 4k36B-4ggpA:
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.
4hfn ALLYL ALCOHOL
DEHYDROGENASE

(Nicotiana
tabacum) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 TYR A 294
TYR A 130
GLU A 311
VAL A 298
ILE A 299
 None
 1.21A 4k36B-4hfnA:
undetectable		 4k36B-4hfnA:
23.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4k37 ANAEROBIC
SULFATASE-MATURATING
ENZYME

(Clostridium
perfringens) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		5 CYH A  22
TYR A  24
GLU A  67
GLN A  64
LEU A 195
 SF4  A 503 ( 2.2A)
SAM  A 504 ( 3.4A)
SAM  A 504 (-4.1A)
None
SAM  A 504 (-4.1A)
 1.09A 4k36B-4k37A:
59.3		 4k36B-4k37A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4k37 ANAEROBIC
SULFATASE-MATURATING
ENZYME

(Clostridium
perfringens) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		12 TYR A  21
CYH A  22
TYR A  24
GLU A  67
GLN A  98
ASN A 100
ARG A 134
LEU A 163
VAL A 165
ILE A 192
CYH A 194
LEU A 195
 SAM  A 504 (-4.6A)
SF4  A 503 ( 2.2A)
SAM  A 504 ( 3.4A)
SAM  A 504 (-4.1A)
SAM  A 504 (-4.4A)
SF4  A 503 ( 4.2A)
SAM  A 504 ( 3.5A)
SAM  A 504 (-3.8A)
SAM  A 504 (-4.7A)
SAM  A 504 (-4.0A)
SAM  A 504 (-4.0A)
SAM  A 504 (-4.1A)
 0.43A 4k36B-4k37A:
59.3		 4k36B-4k37A:
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.
4m77 U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM8

(Saccharomyces
cerevisiae) 		PF01423
(LSM) 		5 GLN A  54
ASN A  40
ARG A  12
LEU A  38
ILE A  15
 None
 1.20A 4k36B-4m77A:
undetectable		 4k36B-4m77A:
14.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m7a U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM8

(Saccharomyces
cerevisiae) 		PF01423
(LSM) 		5 GLN A  54
ASN A  40
ARG A  12
LEU A  38
ILE A  15
 None
 1.24A 4k36B-4m7aA:
undetectable		 4k36B-4m7aA:
13.73
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.
4m7s BTRN

(Bacillus
circulans) 		PF13186
(SPASM) 		5 TYR A  22
CYH A  23
TYR A  62
GLU A  64
ASN A  92
 None
SF4  A 502 (-2.4A)
None
None
SF4  A 502 (-4.5A)
 0.76A 4k36B-4m7sA:
13.7		 4k36B-4m7sA:
27.18
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.
4psp ALPHA-FUCOSIDASE
GH29

(Fusarium
graminearum) 		PF01120
(Alpha_L_fucos)
PF16757
(Fucosidase_C) 		5 ASN A 433
LEU A 471
VAL A 429
ILE A 473
LEU A 450
 None
None
TRS  A 618 (-3.9A)
None
None
 1.44A 4k36B-4pspA:
4.1		 4k36B-4pspA:
21.04
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.
4rgg PUTATIVE PHAGE
STRUCTURAL PROTEIN

(Lactococcus
phage 1358) 		no annotation 5 CYH A 188
TYR A 223
ASN A 371
LEU A 369
ILE A 203
 None
 1.48A 4k36B-4rggA:
undetectable		 4k36B-4rggA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u4e THIOLASE

(Sphaerobacter
thermophilus) 		PF02803
(Thiolase_C) 		5 TYR A  72
CYH A  99
LEU A  87
ILE A 104
LEU A  52
 None
 1.48A 4k36B-4u4eA:
undetectable		 4k36B-4u4eA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v19 MITORIBOSOMAL
PROTEIN BL31M,
MRPL55

(Sus scrofa) 		PF09776
(Mitoc_L55) 		5 ARG 4  73
LEU 4  57
VAL 4  55
ILE 4  67
LEU 4  52
 None
 1.25A 4k36B-4v194:
undetectable		 4k36B-4v194:
15.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wb0 BROAD SPECIFICITY
AMINOTRANSFERASE

(Leishmania
mexicana) 		PF00155
(Aminotran_1_2) 		5 TYR A  93
ASN A 101
VAL A 249
ILE A 247
LEU A 241
 None
 1.39A 4k36B-4wb0A:
undetectable		 4k36B-4wb0A:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xea PEPTIDASE M16 DOMAIN
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 GLU A 265
ARG A 407
LEU A 284
ILE A 283
LEU A 400
 None
 1.42A 4k36B-4xeaA:
undetectable		 4k36B-4xeaA:
22.27
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.
4zad FDC1

(Candida
dubliniensis) 		PF01977
(UbiD) 		5 GLN A 166
ASN A 174
LEU A 262
VAL A 264
LEU A 120
 None
MN  A 601 ( 2.6A)
None
None
None
 1.50A 4k36B-4zadA:
undetectable		 4k36B-4zadA:
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.
4zu4 WXCM-LIKE PROTEIN

(Shewanella
denitrificans) 		PF05523
(FdtA) 		5 ASN A 189
VAL A 233
ILE A 231
CYH A 232
LEU A 252
 None
 1.26A 4k36B-4zu4A:
undetectable		 4k36B-4zu4A:
18.12
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.
5a01 O-GLYCOSYLTRANSFERAS
E

(Drosophila
melanogaster) 		PF13374
(TPR_10)
PF13414
(TPR_11)
PF13844
(Glyco_transf_41) 		5 TYR A 588
TYR A1032
LEU A1039
ILE A 706
LEU A 691
 None
 1.36A 4k36B-5a01A:
undetectable		 4k36B-5a01A:
18.61
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.
5cer BD0816

(Bdellovibrio
bacteriovorus) 		PF02113
(Peptidase_S13) 		5 ASN A 306
LEU A  66
VAL A  62
ILE A  63
LEU A  56
 None
 1.20A 4k36B-5cerA:
undetectable		 4k36B-5cerA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dds CRMG

(Actinoalloteichus
sp. WH1-2216-6) 		PF00202
(Aminotran_3) 		5 GLU A 250
ARG A 303
LEU A 308
ILE A 279
LEU A 203
 None
 1.42A 4k36B-5ddsA:
undetectable		 4k36B-5ddsA:
21.12
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.
5gtk BETAINE-ALDEHYDE
DEHYDROGENASE

(Bacillus cereus) 		PF00171
(Aldedh) 		5 TYR A 483
LEU A 190
VAL A 161
ILE A 188
CYH A 186
 None
 1.16A 4k36B-5gtkA:
undetectable		 4k36B-5gtkA:
21.76
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.
5m4y EXOCYST COMPLEX
COMPONENT SEC3

(Saccharomyces
cerevisiae) 		PF15277
(Sec3-PIP2_bind) 		5 GLU B 103
ASN B 146
LEU B 150
ILE B 151
LEU B 141
 None
 1.32A 4k36B-5m4yB:
undetectable		 4k36B-5m4yB:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n0c TETANUS TOXIN

(Clostridium
tetani) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 GLN A1082
ASN A1078
LEU A1074
ILE A 976
LEU A1000
 None
 1.18A 4k36B-5n0cA:
undetectable		 4k36B-5n0cA:
14.95
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.
5n2g DNA POLYMERASE

(Vaccinia virus) 		no annotation 5 ASN A 720
ARG A 727
LEU A 783
ILE A 778
LEU A 712
 None
 1.33A 4k36B-5n2gA:
undetectable		 4k36B-5n2gA:
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.
5n2g DNA POLYMERASE

(Vaccinia virus) 		no annotation 5 TYR A 697
TYR A 550
ASN A 785
VAL A 782
ILE A 778
 None
 1.45A 4k36B-5n2gA:
undetectable		 4k36B-5n2gA:
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.
5nnp N-TERMINAL
ACETYLTRANSFERASE-LI
KE PROTEIN
PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum;
Chaetomium
thermophilum) 		PF12569
(NARP1)
PF13432
(TPR_16)
PF00583
(Acetyltransf_1) 		5 GLU B 178
ARG A 227
VAL A 223
CYH A 217
LEU A 218
 None
 1.49A 4k36B-5nnpB:
undetectable		 4k36B-5nnpB:
17.55
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.
5uti QUEUINE
TRNA-RIBOSYLTRANSFER
ASE

(Zymomonas
mobilis) 		no annotation 5 CYH A 281
ASN A 350
LEU A 357
ILE A 268
LEU A 259
 None
 1.42A 4k36B-5utiA:
4.4		 4k36B-5utiA:
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.
5vsl RADICAL S-ADENOSYL
METHIONINE
DOMAIN-CONTAINING
PROTEIN 2

(Mus musculus) 		PF04055
(Radical_SAM)
PF13353
(Fer4_12) 		5 CYH A  91
ARG A 194
VAL A 224
CYH A 251
LEU A 252
 SF4  A 401 ( 2.4A)
SAH  A 402 ( 3.4A)
SAH  A 402 (-4.3A)
SAH  A 402 (-3.8A)
SAH  A 402 (-4.5A)
 0.84A 4k36B-5vslA:
19.6		 4k36B-5vslA:
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.
5vsl RADICAL S-ADENOSYL
METHIONINE
DOMAIN-CONTAINING
PROTEIN 2

(Mus musculus) 		PF04055
(Radical_SAM)
PF13353
(Fer4_12) 		6 CYH A  91
GLU A 127
ASN A 158
VAL A 224
CYH A 251
LEU A 252
 SF4  A 401 ( 2.4A)
SAH  A 402 (-4.3A)
SF4  A 401 ( 4.3A)
SAH  A 402 (-4.3A)
SAH  A 402 (-3.8A)
SAH  A 402 (-4.5A)
 0.48A 4k36B-5vslA:
19.6		 4k36B-5vslA:
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.
5wgg RADICAL SAM DOMAIN
PROTEIN

(Ruminiclostridium
thermocellum) 		PF04055
(Radical_SAM)
PF13186
(SPASM)
PF13353
(Fer4_12) 		5 TYR A 110
CYH A 111
GLU A 155
ASN A 188
ARG A 222
 SAM  A 504 (-4.8A)
SF4  A 502 ( 2.4A)
SAM  A 504 (-3.7A)
SF4  A 502 ( 4.3A)
SF4  A 502 ( 3.6A)
 0.18A 4k36B-5wggA:
30.9		 4k36B-5wggA:
22.74
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.
6c3p ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8

(Homo sapiens) 		no annotation 5 TYR E1293
GLN E 444
LEU E 586
ILE E 585
LEU E1288
 None
 1.48A 4k36B-6c3pE:
undetectable		 4k36B-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.
6f1y CYTOPLASMIC DYNEIN 1
LIGHT INTERMEDIATE
CHAIN 2

(Homo sapiens) 		no annotation 5 ASN j 105
LEU j 132
VAL j  59
ILE j 134
LEU j  70
 None
 1.10A 4k36B-6f1yj:
1.7		 4k36B-6f1yj:
undetectable