SIMILAR PATTERNS OF AMINO ACIDS FOR 3PYY_B_STIB4_2

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.
1b4e PROTEIN
(5-AMINOLEVULINIC
ACID DEHYDRATASE)

(Escherichia
coli) 		PF00490
(ALAD) 		4 VAL A 246
ILE A 301
MET A 278
ARG A 226
 None
None
GOL  A 408 ( 4.2A)
SO4  A 402 (-4.5A)
 1.21A 3pyyB-1b4eA:
undetectable		 3pyyB-1b4eA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bjn PHOSPHOSERINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00266
(Aminotran_5) 		4 VAL A  63
ILE A 207
MET A 237
ARG A 211
 None
 1.50A 3pyyB-1bjnA:
undetectable		 3pyyB-1bjnA:
21.14
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.
1dqu ISOCITRATE LYASE

(Aspergillus
nidulans) 		PF00463
(ICL) 		4 LYS A  47
VAL A 187
ILE A  48
ARG A  26
 None
 1.44A 3pyyB-1dquA:
undetectable		 3pyyB-1dquA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e7s GDP-FUCOSE
SYNTHETASE

(Escherichia
coli) 		PF01370
(Epimerase) 		4 VAL A  47
ILE A  91
MET A 225
ARG A  36
 None
None
None
NAP  A1317 (-3.6A)
 1.33A 3pyyB-1e7sA:
0.1		 3pyyB-1e7sA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l4i SFAE PROTEIN

(Escherichia
coli) 		PF00345
(PapD_N)
PF02753
(PapD_C) 		4 VAL A  18
ILE A  50
MET A  57
ARG A   8
 None
 1.37A 3pyyB-1l4iA:
undetectable		 3pyyB-1l4iA:
17.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1opk PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1

(Mus musculus) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07714
(Pkinase_Tyr) 		5 LYS A 290
VAL A 308
ILE A 332
MET A 337
ARG A 381
 P16  A   2 (-4.5A)
None
P16  A   2 (-4.1A)
None
None
 0.93A 3pyyB-1opkA:
34.6		 3pyyB-1opkA:
59.18
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.
1sg3 ALLANTOICASE

(Saccharomyces
cerevisiae) 		PF03561
(Allantoicase) 		4 VAL A  25
ILE A  16
MET A   1
ARG A 161
 None
 1.17A 3pyyB-1sg3A:
undetectable		 3pyyB-1sg3A:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1twy ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Vibrio cholerae) 		PF12727
(PBP_like) 		4 LYS A 214
VAL A 137
ILE A 216
MET A 190
 None
 1.50A 3pyyB-1twyA:
undetectable		 3pyyB-1twyA:
22.00
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.
1whr HYPOTHETICAL
KIAA1002 PROTEIN

(Homo sapiens) 		PF01424
(R3H) 		4 LYS A 177
VAL A 193
ILE A 212
ARG A 224
 None
 1.42A 3pyyB-1whrA:
undetectable		 3pyyB-1whrA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yew PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT

(Methylococcus
capsulatus) 		PF04744
(Monooxygenase_B) 		4 VAL A  81
ILE A 118
MET A 272
ARG A  43
 None
 1.00A 3pyyB-1yewA:
undetectable		 3pyyB-1yewA:
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.
1yww HYPOTHETICAL PROTEIN
PA4738

(Pseudomonas
aeruginosa) 		PF05532
(CsbD) 		4 VAL A  40
ILE A   6
MET A   1
ARG A  53
 None
 1.21A 3pyyB-1ywwA:
undetectable		 3pyyB-1ywwA:
17.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a8x DIHYDROLIPOYL
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 LYS A 262
VAL A 189
ILE A 174
ARG A  87
 None
 0.98A 3pyyB-2a8xA:
undetectable		 3pyyB-2a8xA:
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.
2bud MALES-ABSENT ON THE
FIRST PROTEIN

(Drosophila
melanogaster) 		PF11717
(Tudor-knot) 		4 VAL A 414
ILE A 375
MET A 370
ARG A 394
 None
 1.14A 3pyyB-2budA:
undetectable		 3pyyB-2budA:
14.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2dq7 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE FYN

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LYS X  39
ILE X  80
MET X  85
ARG X 129
 STU  X 902 (-3.1A)
None
None
PTR  X 160 ( 3.4A)
 0.98A 3pyyB-2dq7X:
31.8		 3pyyB-2dq7X:
43.48
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.
2dw1 CATROCOLLASTATIN

(Crotalus atrox) 		PF00200
(Disintegrin)
PF01421
(Reprolysin)
PF08516
(ADAM_CR) 		4 VAL A 329
ILE A 317
MET A 307
ARG A 358
 None
 1.19A 3pyyB-2dw1A:
undetectable		 3pyyB-2dw1A:
19.95
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.
2gjv PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF09646
(Gp37) 		4 VAL A   6
ILE A  25
MET A  21
ARG A  67
 None
 1.46A 3pyyB-2gjvA:
2.4		 3pyyB-2gjvA:
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.
2h31 MULTIFUNCTIONAL
PROTEIN ADE2

(Homo sapiens) 		PF00731
(AIRC)
PF01259
(SAICAR_synt) 		4 LYS A  53
VAL A 252
ILE A  56
ARG A 215
 None
 1.44A 3pyyB-2h31A:
5.2		 3pyyB-2h31A:
20.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hk5 TYROSINE-PROTEIN
KINASE HCK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LYS A 273
VAL A 291
ILE A 314
MET A 319
 1BM  A 499 (-3.8A)
None
1BM  A 499 (-3.9A)
None
 0.72A 3pyyB-2hk5A:
27.3		 3pyyB-2hk5A:
45.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hz0 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LYS A 271
VAL A 289
ILE A 313
ARG A 362
 GIN  A 600 (-3.6A)
None
GIN  A 600 (-3.8A)
None
 1.22A 3pyyB-2hz0A:
34.2		 3pyyB-2hz0A:
95.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hz0 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 VAL A 289
ILE A 313
MET A 318
ARG A 362
 None
GIN  A 600 (-3.8A)
None
None
 0.74A 3pyyB-2hz0A:
34.2		 3pyyB-2hz0A:
95.05
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.
2k22 PUTATIVE
UNCHARACTERIZED
PROTEIN TA0895

(Thermoplasma
acidophilum) 		PF02597
(ThiS) 		4 VAL A   4
ILE A  58
MET A  68
ARG A  33
 None
 1.44A 3pyyB-2k22A:
undetectable		 3pyyB-2k22A:
12.75
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.
2msk NITROGEN REGULATION
PROTEIN NR(I)

(Salmonella
enterica) 		PF00072
(Response_reg) 		4 LYS A  70
VAL A  50
ILE A  69
ARG A 117
 None
 1.45A 3pyyB-2mskA:
undetectable		 3pyyB-2mskA:
17.35
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.
2z83 HELICASE/NUCLEOSIDE
TRIPHOSPHATASE

(Japanese
encephalitis
virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		4 VAL A 221
ILE A 301
MET A 495
ARG A 242
 None
 1.26A 3pyyB-2z83A:
undetectable		 3pyyB-2z83A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 VAL O 385
ILE O 299
MET O 485
ARG O 470
 None
 1.09A 3pyyB-2zf5O:
0.8		 3pyyB-2zf5O:
20.41
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.
3abi PUTATIVE
UNCHARACTERIZED
PROTEIN PH1688

(Pyrococcus
horikoshii) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 VAL A 113
ILE A  66
MET A 295
ARG A 328
 None
None
NAD  A1001 ( 3.9A)
None
 1.41A 3pyyB-3abiA:
undetectable		 3pyyB-3abiA:
24.18
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.
3bh2 ACETOACETATE
DECARBOXYLASE

(Clostridium
acetobutylicum) 		PF06314
(ADC) 		4 LYS A 169
ILE A 184
MET A  96
ARG A  21
 None
 1.31A 3pyyB-3bh2A:
undetectable		 3pyyB-3bh2A:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d79 PUTATIVE
UNCHARACTERIZED
PROTEIN PH0734

(Pyrococcus
horikoshii) 		PF01472
(PUA)
PF09183
(DUF1947) 		4 VAL A 158
ILE A  61
MET A  33
ARG A 163
 None
 1.45A 3pyyB-3d79A:
undetectable		 3pyyB-3d79A:
22.64
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.
3fdq MOTILITY GENE
REPRESSOR MOGR

(Listeria
monocytogenes) 		PF12181
(MogR_DNAbind) 		4 LYS A 135
VAL A  56
ILE A  70
ARG A 107
 None
 1.33A 3pyyB-3fdqA:
undetectable		 3pyyB-3fdqA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ff4 UNCHARACTERIZED
PROTEIN

(Cytophaga
hutchinsonii) 		PF13380
(CoA_binding_2) 		4 VAL A  41
ILE A  32
MET A   1
ARG A  15
 None
 1.43A 3pyyB-3ff4A:
undetectable		 3pyyB-3ff4A:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3igo CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 VAL A 195
ILE A 217
MET A 399
ARG A 320
 None
 1.39A 3pyyB-3igoA:
19.8		 3pyyB-3igoA:
25.43
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.
3lk6 LIPOPROTEIN YBBD

(Bacillus
subtilis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 VAL A 335
ILE A 377
MET A  42
ARG A 363
 None
 1.49A 3pyyB-3lk6A:
undetectable		 3pyyB-3lk6A:
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.
3lvr ARF-GAP WITH SH3
DOMAIN, ANK REPEAT
AND PH
DOMAIN-CONTAINING
PROTEIN 3,
ADP-RIBOSYLATION
FACTOR 6

(Homo sapiens;
synthetic
construct) 		PF00025
(Arf)
PF01412
(ArfGap)
PF12796
(Ank_2) 		4 VAL E  88
ILE E  29
MET E  14
ARG E  71
 None
None
None
CA  E 739 ( 4.3A)
 1.50A 3pyyB-3lvrE:
undetectable		 3pyyB-3lvrE:
20.68
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.
3w4k D-AMINO-ACID OXIDASE

(Homo sapiens) 		PF01266
(DAO) 		4 LYS A 337
VAL A 305
ILE A 333
ARG A 172
 None
 1.38A 3pyyB-3w4kA:
undetectable		 3pyyB-3w4kA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wv4 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
halstedii) 		PF00501
(AMP-binding) 		4 LYS A 235
VAL A 212
ILE A 238
ARG A 322
 None
 1.43A 3pyyB-3wv4A:
undetectable		 3pyyB-3wv4A:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a7k ALDOS-2-ULOSE
DEHYDRATASE

(Phanerochaete
chrysosporium) 		no annotation 4 VAL A 407
ILE A 395
MET A  97
ARG A 279
 None
 1.45A 3pyyB-4a7kA:
undetectable		 3pyyB-4a7kA:
15.41
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.
4btg MAJOR INNER PROTEIN
P1

(Pseudomonas
virus phi6) 		no annotation 4 LYS A 677
VAL A 749
ILE A 678
ARG A 417
 None
 1.43A 3pyyB-4btgA:
undetectable		 3pyyB-4btgA:
17.02
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.
4fnq ALPHA-GALACTOSIDASE
AGAB

(Geobacillus
stearothermophilus) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		4 VAL A 455
ILE A 460
MET A 541
ARG A 502
 None
 1.29A 3pyyB-4fnqA:
undetectable		 3pyyB-4fnqA:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gfj TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 VAL A  27
ILE A 278
MET A  40
ARG A 112
 None
 1.26A 3pyyB-4gfjA:
undetectable		 3pyyB-4gfjA:
17.83
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.
4hds ARSB

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		4 LYS B  43
VAL B 267
ILE B  47
MET B 311
 None
 1.49A 3pyyB-4hdsB:
undetectable		 3pyyB-4hdsB:
19.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lgg PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC

(Gallus gallus) 		PF07714
(Pkinase_Tyr) 		4 LYS A 295
VAL A 313
ILE A 336
ARG A 385
 VGG  A 601 (-3.8A)
None
VGG  A 601 (-4.2A)
None
 1.34A 3pyyB-4lggA:
30.4		 3pyyB-4lggA:
45.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lgg PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC

(Gallus gallus) 		PF07714
(Pkinase_Tyr) 		4 VAL A 313
ILE A 336
MET A 341
ARG A 385
 None
VGG  A 601 (-4.2A)
None
None
 1.02A 3pyyB-4lggA:
30.4		 3pyyB-4lggA:
45.15
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.
4pu6 L-ASPARAGINASE ALPHA
SUBUNIT
L-ASPARAGINASE BETA
SUBUNIT

(Phaseolus
vulgaris) 		PF01112
(Asparaginase_2) 		4 VAL B 197
ILE B 292
MET B 320
ARG A  56
 None
 1.15A 3pyyB-4pu6B:
undetectable		 3pyyB-4pu6B:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r3a BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2

(Erythrobacter
litoralis) 		PF07568
(HisKA_2)
PF13426
(PAS_9)
PF13581
(HATPase_c_2) 		4 VAL A 247
ILE A 240
MET A 271
ARG A 305
 None
 1.36A 3pyyB-4r3aA:
undetectable		 3pyyB-4r3aA:
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.
4uiq GLOBIN-COUPLED
SENSOR WITH
DIGUANYLATE CYCLASE
ACTIVITY

(Bordetella
pertussis) 		PF11563
(Protoglobin) 		4 VAL A 145
ILE A 117
MET A  46
ARG A  28
 None
None
HEM  A 200 (-3.3A)
None
 1.32A 3pyyB-4uiqA:
undetectable		 3pyyB-4uiqA:
16.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v0j ACYL-[ACYL-CARRIER-P
ROTEIN] DESATURASE,
CHLOROPLASTIC

(Ricinus
communis) 		PF03405
(FA_desaturase_2) 		4 VAL A 305
ILE A 190
MET A 265
ARG A 329
 None
 0.79A 3pyyB-4v0jA:
undetectable		 3pyyB-4v0jA:
24.86
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.
4xpz RNA POLYMERASE II
SUBUNIT A C-TERMINAL
DOMAIN PHOSPHATASE

(Schizosaccharomyces
pombe) 		PF03031
(NIF)
PF12738
(PTCB-BRCT) 		4 LYS A 425
VAL A 295
ILE A 421
ARG A 299
 None
 1.27A 3pyyB-4xpzA:
undetectable		 3pyyB-4xpzA:
20.05
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.
5a5t EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT A
EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT M

(Oryctolagus
cuniculus) 		PF01399
(PCI) 		4 LYS M 331
VAL A 443
ILE M 325
MET M 277
 None
 1.17A 3pyyB-5a5tM:
undetectable		 3pyyB-5a5tM:
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.
5c7i GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC

(Mus musculus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 VAL O 110
ILE O 177
MET O 149
ARG O 433
 None
 1.39A 3pyyB-5c7iO:
undetectable		 3pyyB-5c7iO:
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.
5c7o GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
TESTIS-SPECIFIC

(Homo sapiens) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 VAL O  78
ILE O 145
MET O 117
ARG O 401
 None
 1.40A 3pyyB-5c7oO:
undetectable		 3pyyB-5c7oO:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ck0 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 VAL A 187
ILE A 163
MET A 636
ARG A 225
 None
 1.43A 3pyyB-5ck0A:
undetectable		 3pyyB-5ck0A:
20.77
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.
5ej1 PUTATIVE CELLULOSE
SYNTHASE

(Rhodobacter
sphaeroides) 		PF03170
(BcsB) 		4 VAL B 378
ILE B 340
MET B 438
ARG B 402
 None
 1.19A 3pyyB-5ej1B:
undetectable		 3pyyB-5ej1B:
17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fp2 FERRIC ENTEROBACTIN
RECEPTOR PIRA

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 VAL A 123
ILE A  93
MET A  61
ARG A 157
 None
 1.28A 3pyyB-5fp2A:
undetectable		 3pyyB-5fp2A:
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.
5gaf SIGNAL RECOGNITION
PARTICLE PROTEIN

(Escherichia
coli) 		PF00466
(Ribosomal_L10) 		4 VAL i  27
ILE i  77
MET i 297
ARG i  21
 None
 1.48A 3pyyB-5gafi:
undetectable		 3pyyB-5gafi:
22.08
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.
5hm5 TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 VAL A  27
ILE A 278
MET A  40
ARG A 112
 None
 1.14A 3pyyB-5hm5A:
undetectable		 3pyyB-5hm5A:
16.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iip GLYCINE
BETAINE/CARNITINE/CH
OLINE ABC
TRANSPORTER%2C
ATP-BINDING
PROTEIN%2C PUTATIVE

(Staphylococcus
aureus) 		PF00571
(CBS) 		4 VAL A 344
ILE A 256
MET A 274
ARG A 350
 None
 1.43A 3pyyB-5iipA:
undetectable		 3pyyB-5iipA:
22.15
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.
5znn SORTILIN

(Mus musculus) 		no annotation 4 VAL A 483
ILE A 525
MET A 516
ARG A 653
 None
 1.47A 3pyyB-5znnA:
undetectable		 3pyyB-5znnA:
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.
6b4m MONOTREME LACTATION
PROTEIN

(Ornithorhynchus
anatinus) 		no annotation 4 VAL A 218
ILE A 248
MET A 272
ARG A 328
 None
 1.48A 3pyyB-6b4mA:
undetectable		 3pyyB-6b4mA:
15.02
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.
6b5i RETINAL
DEHYDROGENASE 2

(Homo sapiens) 		no annotation 4 VAL A 407
ILE A 326
MET A 464
ARG A 412
 None
 1.35A 3pyyB-6b5iA:
undetectable		 3pyyB-6b5iA:
12.89
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.
6cn0 16S RRNA
(GUANINE(1405)-N(7))
-METHYLTRANSFERASE

(Proteus
mirabilis) 		no annotation 4 LYS A 267
VAL A 258
ILE A 264
MET A 202
 None
 0.98A 3pyyB-6cn0A:
undetectable		 3pyyB-6cn0A:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cpy GRMZM2G135359
PSEUDOKINASE

(Zea mays) 		no annotation 4 VAL A 480
ILE A 338
MET A 329
ARG A 464
 None
 1.37A 3pyyB-6cpyA:
20.8		 3pyyB-6cpyA:
13.29
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.
6g2j NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
9, MITOCHONDRIAL

(Mus musculus) 		no annotation 4 LYS P 283
VAL P 242
ILE P 287
ARG P 186
 None
 1.23A 3pyyB-6g2jP:
undetectable		 3pyyB-6g2jP:
11.22