SIMILAR PATTERNS OF AMINO ACIDS FOR 2Y69_P_CHDP1265

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.
1a0e XYLOSE ISOMERASE

(Thermotoga
neapolitana) 		PF01261
(AP_endonuc_2) 		4 PHE A 228
PHE A 262
LEU A 253
PHE A 252
 None
 1.26A 2y69P-1a0eA:
undetectable
2y69W-1a0eA:
0.0		 2y69P-1a0eA:
18.69
2y69W-1a0eA:
10.40
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.
1bc5 CHEMOTAXIS RECEPTOR
METHYLTRANSFERASE

(Salmonella
enterica) 		PF01739
(CheR)
PF03705
(CheR_N) 		4 PHE A 103
PHE A  97
LEU A 176
PHE A 185
 None
 1.22A 2y69P-1bc5A:
undetectable
2y69W-1bc5A:
0.0		 2y69P-1bc5A:
21.93
2y69W-1bc5A:
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.
1cpy SERINE
CARBOXYPEPTIDASE

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		4 PHE A  32
PHE A  31
LEU A  59
PHE A  63
 None
 1.34A 2y69P-1cpyA:
1.0
2y69W-1cpyA:
0.0		 2y69P-1cpyA:
19.39
2y69W-1cpyA:
11.23
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.
1gm5 RECG

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF17190
(RecG_N)
PF17191
(RecG_wedge) 		4 PHE A 441
PHE A 361
LEU A 365
PHE A 367
 None
None
None
ADP  A1756 (-3.3A)
 1.25A 2y69P-1gm5A:
3.0
2y69W-1gm5A:
0.2		 2y69P-1gm5A:
15.64
2y69W-1gm5A:
7.77
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.
1gz5 ALPHA-TREHALOSE-PHOS
PHATE SYNTHASE

(Escherichia
coli) 		PF00982
(Glyco_transf_20) 		4 PHE A  97
PHE A  79
LEU A  84
PHE A  88
 None
 1.24A 2y69P-1gz5A:
undetectable
2y69W-1gz5A:
0.0		 2y69P-1gz5A:
19.91
2y69W-1gz5A:
10.42
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.
1hbr PROTEIN (HEMOGLOBIN
D)

(Gallus gallus) 		PF00042
(Globin) 		4 PHE A 128
PHE A 125
LEU A 109
PHE A  24
 None
 1.31A 2y69P-1hbrA:
0.8
2y69W-1hbrA:
0.0		 2y69P-1hbrA:
18.99
2y69W-1hbrA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kl7 THREONINE SYNTHASE

(Saccharomyces
cerevisiae) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		4 ARG A 319
PHE A 311
PHE A 376
LEU A 370
 None
 1.32A 2y69P-1kl7A:
0.0
2y69W-1kl7A:
0.0		 2y69P-1kl7A:
21.24
2y69W-1kl7A:
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.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		4 PHE A 368
PHE A 194
LEU A 345
PHE A 335
 None
 1.34A 2y69P-1lfwA:
0.3
2y69W-1lfwA:
0.0		 2y69P-1lfwA:
19.87
2y69W-1lfwA:
9.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qp8 FORMATE
DEHYDROGENASE

(Pyrobaculum
aerophilum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 ARG A  25
PHE A  21
LEU A   9
PHE A   7
 None
 1.32A 2y69P-1qp8A:
0.9
2y69W-1qp8A:
0.0		 2y69P-1qp8A:
22.73
2y69W-1qp8A:
11.82
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.
1tq5 PROTEIN YHHW

(Escherichia
coli) 		PF02678
(Pirin) 		4 PHE A  34
PHE A  24
LEU A  40
PHE A 226
 None
 1.33A 2y69P-1tq5A:
undetectable
2y69W-1tq5A:
undetectable		 2y69P-1tq5A:
20.88
2y69W-1tq5A:
15.38
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.
1tzn ANTHRAX TOXIN
RECEPTOR 2

(Homo sapiens) 		PF03495
(Binary_toxB)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 PHE a1043
PHE a1073
LEU a1069
PHE a1065
 None
 1.27A 2y69P-1tzna:
undetectable
2y69W-1tzna:
undetectable		 2y69P-1tzna:
20.80
2y69W-1tzna:
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.
1vfn PURINE-NUCLEOSIDE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		4 PHE A  98
PHE A  56
LEU A  68
PHE A  70
 None
 1.10A 2y69P-1vfnA:
undetectable
2y69W-1vfnA:
undetectable		 2y69P-1vfnA:
24.03
2y69W-1vfnA:
12.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w93 ACETYL-COENZYME A
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A 533
PHE A 490
LEU A 478
PHE A 480
 None
 1.23A 2y69P-1w93A:
undetectable
2y69W-1w93A:
undetectable		 2y69P-1w93A:
18.93
2y69W-1w93A:
10.49
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.
1wrj METHYLATED-DNA--PROT
EIN-CYSTEINE
METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01035
(DNA_binding_1) 		4 PHE A  11
PHE A  53
LEU A  49
PHE A  45
 None
 1.31A 2y69P-1wrjA:
undetectable
2y69W-1wrjA:
undetectable		 2y69P-1wrjA:
16.60
2y69W-1wrjA:
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 PHE A 363
PHE A 369
LEU A 371
PHE A 356
 None
 1.24A 2y69P-2b39A:
undetectable
2y69W-2b39A:
undetectable		 2y69P-2b39A:
9.83
2y69W-2b39A:
4.00
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.
2bl0 MYOSIN REGULATORY
LIGHT CHAIN

(Physarum
polycephalum) 		PF13833
(EF-hand_8) 		4 PHE C 148
PHE C 132
LEU C 113
PHE C 100
 None
 1.00A 2y69P-2bl0C:
undetectable
2y69W-2bl0C:
undetectable		 2y69P-2bl0C:
21.40
2y69W-2bl0C:
24.03
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.
2bru NAD(P)
TRANSHYDROGENASE
SUBUNIT ALPHA

(Escherichia
coli) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		4 PHE A1242
PHE A1194
LEU A1214
PHE A1216
 None
 1.28A 2y69P-2bruA:
undetectable
2y69W-2bruA:
undetectable		 2y69P-2bruA:
22.37
2y69W-2bruA:
11.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cfe ALLERGEN

(Malassezia
sympodialis) 		PF00160
(Pro_isomerase) 		4 ARG A  35
PHE A 110
PHE A 127
LEU A  22
 None
 1.34A 2y69P-2cfeA:
undetectable
2y69W-2cfeA:
undetectable		 2y69P-2cfeA:
19.17
2y69W-2cfeA:
16.35
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.
2czo BUD EMERGENCE
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00787
(PX) 		4 PHE A 300
PHE A 321
LEU A 396
PHE A 397
 None
 1.28A 2y69P-2czoA:
undetectable
2y69W-2czoA:
undetectable		 2y69P-2czoA:
20.61
2y69W-2czoA:
18.47
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.
2hf8 PROBABLE HYDROGENASE
NICKEL INCORPORATION
PROTEIN HYPB

(Methanocaldococcus
jannaschii) 		PF02492
(cobW) 		4 PHE A  36
PHE A  38
LEU A  49
PHE A 206
 None
 1.34A 2y69P-2hf8A:
undetectable
2y69W-2hf8A:
undetectable		 2y69P-2hf8A:
19.93
2y69W-2hf8A:
15.38
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.
2i6x HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Porphyromonas
gingivalis) 		PF13419
(HAD_2) 		4 PHE A   7
PHE A 134
LEU A 130
PHE A 123
 None
 1.27A 2y69P-2i6xA:
undetectable
2y69W-2i6xA:
undetectable		 2y69P-2i6xA:
20.30
2y69W-2i6xA:
16.59
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.
2ice COMPLEMENT C3 BETA
CHAIN

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		4 PHE A 342
PHE A 348
LEU A 350
PHE A 335
 None
 1.26A 2y69P-2iceA:
undetectable
2y69W-2iceA:
undetectable		 2y69P-2iceA:
17.76
2y69W-2iceA:
9.59
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.
2owy RECOMBINATION-ASSOCI
ATED PROTEIN RDGC

(Pseudomonas
aeruginosa) 		PF04381
(RdgC) 		4 PHE A   3
PHE A 286
LEU A 290
PHE A 294
 None
 1.36A 2y69P-2owyA:
undetectable
2y69W-2owyA:
undetectable		 2y69P-2owyA:
20.38
2y69W-2owyA:
13.64
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.
2p1n SKP1-LIKE PROTEIN 1A
TRANSPORT INHIBITOR
RESPONSE 1 PROTEIN

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF01466
(Skp1)
PF03931
(Skp1_POZ)
PF12937
(F-box-like) 		4 PHE A  99
PHE B   9
LEU B  14
PHE B  18
 None
 0.98A 2y69P-2p1nA:
undetectable
2y69W-2p1nA:
undetectable		 2y69P-2p1nA:
18.58
2y69W-2p1nA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2paj PUTATIVE
CYTOSINE/GUANINE
DEAMINASE

(unidentified) 		PF01979
(Amidohydro_1) 		4 PHE A  80
PHE A 115
LEU A 153
PHE A 164
 None
 1.21A 2y69P-2pajA:
undetectable
2y69W-2pajA:
undetectable		 2y69P-2pajA:
21.47
2y69W-2pajA:
9.55
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.
2q03 UNCHARACTERIZED
PROTEIN

(Shewanella
denitrificans) 		PF11528
(DUF3224) 		4 PHE A 111
PHE A  83
LEU A  85
PHE A 100
 None
 1.22A 2y69P-2q03A:
undetectable
2y69W-2q03A:
undetectable		 2y69P-2q03A:
20.31
2y69W-2q03A:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qec HISTONE
ACETYLTRANSFERASE
HPA2 AND RELATED
ACETYLTRANSFERASES

(Corynebacterium
glutamicum) 		PF00583
(Acetyltransf_1) 		4 PHE A  24
PHE A  48
LEU A  47
PHE A 101
 None
 1.23A 2y69P-2qecA:
undetectable
2y69W-2qecA:
undetectable		 2y69P-2qecA:
20.22
2y69W-2qecA:
19.29
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.
2toh TYROSINE
3-MONOOXYGENASE

(Rattus
norvegicus) 		PF00351
(Biopterin_H) 		4 PHE A 348
PHE A 345
LEU A 340
PHE A 309
 None
None
None
MTY  A 300 ( 3.9A)
 1.18A 2y69P-2tohA:
undetectable
2y69W-2tohA:
undetectable		 2y69P-2tohA:
21.19
2y69W-2tohA:
11.95
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.
2ww2 ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		PF07971
(Glyco_hydro_92) 		4 PHE A 242
PHE A 158
LEU A 141
PHE A 137
 None
 1.29A 2y69P-2ww2A:
undetectable
2y69W-2ww2A:
undetectable		 2y69P-2ww2A:
16.60
2y69W-2ww2A:
8.12
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		4 PHE A 402
PHE A 403
LEU A 455
PHE A 464
 None
 1.34A 2y69P-2x05A:
undetectable
2y69W-2x05A:
undetectable		 2y69P-2x05A:
14.08
2y69W-2x05A:
5.92
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.
2xvs TETRATRICOPEPTIDE
REPEAT PROTEIN 5

(Homo sapiens) 		PF16669
(TTC5_OB) 		4 ARG A 273
PHE A 343
LEU A 345
PHE A 270
 None
 1.14A 2y69P-2xvsA:
undetectable
2y69W-2xvsA:
undetectable		 2y69P-2xvsA:
19.25
2y69W-2xvsA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z6v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF13469
(Sulfotransfer_3) 		4 ARG A  53
PHE A 187
LEU A  57
PHE A   4
 None
 1.35A 2y69P-2z6vA:
undetectable
2y69W-2z6vA:
undetectable		 2y69P-2z6vA:
17.17
2y69W-2z6vA:
11.50
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.
3b7y E3 UBIQUITIN-PROTEIN
LIGASE NEDD4

(Homo sapiens) 		PF00168
(C2) 		4 PHE A 109
PHE A 178
LEU A 187
PHE A 189
 None
 1.33A 2y69P-3b7yA:
undetectable
2y69W-3b7yA:
undetectable		 2y69P-3b7yA:
21.35
2y69W-3b7yA:
21.99
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.
3erw SPORULATION
THIOL-DISULFIDE
OXIDOREDUCTASE A

(Bacillus
subtilis) 		PF00578
(AhpC-TSA) 		4 PHE A  75
PHE A 115
LEU A 113
PHE A 107
 None
 1.18A 2y69P-3erwA:
undetectable
2y69W-3erwA:
undetectable		 2y69P-3erwA:
16.48
2y69W-3erwA:
15.60
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.
3hf8 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 289
PHE A 286
LEU A 281
PHE A 250
 None
 1.31A 2y69P-3hf8A:
undetectable
2y69W-3hf8A:
undetectable		 2y69P-3hf8A:
21.23
2y69W-3hf8A:
14.64
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.
3iey TRNA-SPLICING
ENDONUCLEASE
NEQ261

(Nanoarchaeum
equitans;
Nanoarchaeum
equitans) 		PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N)
PF01974
(tRNA_int_endo) 		4 PHE B  83
PHE B 130
LEU B 132
PHE A 118
 None
 1.31A 2y69P-3ieyB:
undetectable
2y69W-3ieyB:
undetectable		 2y69P-3ieyB:
21.43
2y69W-3ieyB:
20.38
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.
3jb4 VP3

(Parechovirus B) 		PF00073
(Rhv) 		4 PHE C 129
PHE C 149
LEU C 201
PHE C 103
 None
 1.35A 2y69P-3jb4C:
undetectable
2y69W-3jb4C:
undetectable		 2y69P-3jb4C:
19.72
2y69W-3jb4C:
16.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k94 THIAMIN
PYROPHOSPHOKINASE

(Geobacillus
thermodenitrificans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 PHE A 199
PHE A 164
LEU A 166
PHE A 169
 None
 1.33A 2y69P-3k94A:
undetectable
2y69W-3k94A:
undetectable		 2y69P-3k94A:
22.10
2y69W-3k94A:
17.49
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.
3khs PURINE NUCLEOSIDE
PHOSPHORYLASE

(Singapore
grouper
iridovirus) 		PF01048
(PNP_UDP_1) 		4 PHE A  95
PHE A  53
LEU A  65
PHE A  67
 None
 1.09A 2y69P-3khsA:
undetectable
2y69W-3khsA:
undetectable		 2y69P-3khsA:
21.71
2y69W-3khsA:
16.19
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.
3l9t PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.31

(Streptococcus
mutans) 		PF08713
(DNA_alkylation) 		4 PHE A  97
PHE A  94
LEU A 129
PHE A 138
 None
 1.33A 2y69P-3l9tA:
undetectable
2y69W-3l9tA:
undetectable		 2y69P-3l9tA:
18.87
2y69W-3l9tA:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mjd OROTATE
PHOSPHORIBOSYLTRANSF
ERASE

(Francisella
tularensis) 		PF00156
(Pribosyltran) 		4 PHE A 105
PHE A  62
LEU A 117
PHE A 128
 None
 1.34A 2y69P-3mjdA:
undetectable
2y69W-3mjdA:
undetectable		 2y69P-3mjdA:
21.86
2y69W-3mjdA:
17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o57 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 ARG A 331
PHE A 216
LEU A 315
PHE A 312
 None
 1.15A 2y69P-3o57A:
1.8
2y69W-3o57A:
undetectable		 2y69P-3o57A:
20.05
2y69W-3o57A:
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 PHE A 327
PHE A 299
LEU A 296
PHE A 294
 None
 0.93A 2y69P-3ogrA:
undetectable
2y69W-3ogrA:
undetectable		 2y69P-3ogrA:
14.48
2y69W-3ogrA:
5.91
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.
3pao ADENOSINE DEAMINASE

(Pseudomonas
aeruginosa) 		PF00962
(A_deaminase) 		4 PHE A 158
PHE A 162
LEU A 137
PHE A 139
 None
 1.30A 2y69P-3paoA:
undetectable
2y69W-3paoA:
undetectable		 2y69P-3paoA:
20.29
2y69W-3paoA:
12.27
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.
3q33 HISTONE
ACETYLTRANSFERASE
RTT109

(Saccharomyces
cerevisiae) 		PF08214
(HAT_KAT11) 		4 ARG A 318
PHE A 311
LEU A 315
PHE A 321
 None
 1.18A 2y69P-3q33A:
undetectable
2y69W-3q33A:
undetectable		 2y69P-3q33A:
19.95
2y69W-3q33A:
11.24
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.
3q4i PHOSPHOHYDROLASE
(MUTT/NUDIX FAMILY
PROTEIN)

(Bacillus cereus) 		PF00293
(NUDIX)
PF12535
(Nudix_N) 		4 PHE A 130
PHE A 148
LEU A  94
PHE A  83
 None
 1.03A 2y69P-3q4iA:
3.5
2y69W-3q4iA:
undetectable		 2y69P-3q4iA:
20.44
2y69W-3q4iA:
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.
3t66 NICKEL ABC
TRANSPORTER
(NICKEL-BINDING
PROTEIN)

(Bacillus
halodurans) 		PF00496
(SBP_bac_5) 		4 PHE A  19
PHE A 193
LEU A 173
PHE A 167
 None
 1.32A 2y69P-3t66A:
undetectable
2y69W-3t66A:
undetectable		 2y69P-3t66A:
20.72
2y69W-3t66A:
9.81
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.
3v44 TOLL-LIKE RECEPTOR
5B AND VARIABLE
LYMPHOCYTE RECEPTOR
B.61 CHIMERIC
PROTEIN

(Eptatretus
burgeri;
Danio rerio) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		4 PHE A 312
PHE A 315
LEU A 289
PHE A 250
 None
 1.12A 2y69P-3v44A:
undetectable
2y69W-3v44A:
undetectable		 2y69P-3v44A:
19.86
2y69W-3v44A:
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.
3vx8 UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME ATG7

(Arabidopsis
thaliana) 		no annotation 4 PHE D  28
PHE D  24
LEU D  63
PHE D 137
 None
 1.17A 2y69P-3vx8D:
undetectable
2y69W-3vx8D:
undetectable		 2y69P-3vx8D:
17.61
2y69W-3vx8D:
12.81
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 PHE A 250
PHE A 218
LEU A 119
PHE A 118
 None
 1.28A 2y69P-3wzfA:
undetectable
2y69W-3wzfA:
undetectable		 2y69P-3wzfA:
20.62
2y69W-3wzfA:
10.73
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.
4cxf RNA POLYMERASE SIGMA
FACTOR CNRH

(Cupriavidus
metallidurans) 		PF04542
(Sigma70_r2)
PF08281
(Sigma70_r4_2) 		4 PHE A  55
PHE A  22
LEU A  62
PHE A  65
 None
 1.10A 2y69P-4cxfA:
undetectable
2y69W-4cxfA:
undetectable		 2y69P-4cxfA:
19.71
2y69W-4cxfA:
18.65
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.
4d7q RALF,
PROLINE/BETAINE
TRANSPORTER

(Legionella
pneumophila;
Rickettsia
prowazekii) 		PF01369
(Sec7) 		4 PHE A 286
PHE A 196
LEU A 194
PHE A 192
 None
EPE  A1347 (-3.5A)
None
None
 1.25A 2y69P-4d7qA:
undetectable
2y69W-4d7qA:
undetectable		 2y69P-4d7qA:
19.79
2y69W-4d7qA:
11.68
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.
4f2a CHOLESTERYL ESTER
TRANSFER PROTEIN

(Homo sapiens) 		PF01273
(LBP_BPI_CETP)
PF02886
(LBP_BPI_CETP_C) 		4 PHE A 463
PHE A 461
LEU A 261
PHE A 263
 2OB  A 605 (-4.6A)
2OB  A 605 (-3.9A)
0SF  A 610 ( 4.3A)
0SF  A 610 ( 4.1A)
 1.29A 2y69P-4f2aA:
undetectable
2y69W-4f2aA:
undetectable		 2y69P-4f2aA:
19.43
2y69W-4f2aA:
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.
4frt PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 PHE A 120
PHE A 130
LEU A 150
PHE A 187
 None
 1.32A 2y69P-4frtA:
undetectable
2y69W-4frtA:
undetectable		 2y69P-4frtA:
20.34
2y69W-4frtA:
12.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		4 PHE A 180
PHE A 177
LEU A 158
PHE A 160
 None
 0.94A 2y69P-4j72A:
1.3
2y69W-4j72A:
undetectable		 2y69P-4j72A:
22.37
2y69W-4j72A:
13.22
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.
4k0x BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 PHE A 180
PHE A 152
LEU A 170
PHE A 164
 None
 1.35A 2y69P-4k0xA:
undetectable
2y69W-4k0xA:
undetectable		 2y69P-4k0xA:
19.42
2y69W-4k0xA:
18.10
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 245
PHE A 269
LEU A 273
PHE A 277
 None
 1.15A 2y69P-4n5cA:
undetectable
2y69W-4n5cA:
undetectable		 2y69P-4n5cA:
14.04
2y69W-4n5cA:
7.38
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.
4ud4 POLY(A) RNA
POLYMERASE PROTEIN
CID1

(Schizosaccharomyces
pombe) 		PF01909
(NTP_transf_2)
PF03828
(PAP_assoc) 		4 PHE A 153
PHE A 130
LEU A 125
PHE A 121
 None
 1.11A 2y69P-4ud4A:
undetectable
2y69W-4ud4A:
undetectable		 2y69P-4ud4A:
19.95
2y69W-4ud4A:
12.68
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.
4v06 TRYPTOPHAN
5-HYDROXYLASE 2

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 335
PHE A 332
LEU A 327
PHE A 296
 None
None
None
IMD  A 600 (-4.7A)
 1.30A 2y69P-4v06A:
undetectable
2y69W-4v06A:
undetectable		 2y69P-4v06A:
21.41
2y69W-4v06A:
12.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wpx CELL DIVISION
CONTROL PROTEIN
31-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		4 ARG A  27
PHE A  50
PHE A  35
LEU A  34
 None
 0.99A 2y69P-4wpxA:
undetectable
2y69W-4wpxA:
undetectable		 2y69P-4wpxA:
21.84
2y69W-4wpxA:
17.22
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.
4wy9 PUTATIVE MCP-TYPE
SIGNAL TRANSDUCTION
PROTEIN

(Campylobacter
jejuni) 		PF02743
(dCache_1) 		4 PHE A 127
PHE A 134
LEU A 113
PHE A  79
 None
 1.23A 2y69P-4wy9A:
undetectable
2y69W-4wy9A:
undetectable		 2y69P-4wy9A:
22.01
2y69W-4wy9A:
15.59
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.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 ARG A 503
PHE A 388
LEU A 487
PHE A 484
 IOD  A 805 (-4.3A)
None
None
IOD  A 805 ( 4.9A)
 1.17A 2y69P-4wziA:
undetectable
2y69W-4wziA:
undetectable		 2y69P-4wziA:
16.59
2y69W-4wziA:
8.55
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.
4x8q UNCHARACTERIZED
PROTEIN

(Streptococcus
mutans) 		PF08713
(DNA_alkylation) 		4 PHE A  97
PHE A  94
LEU A 129
PHE A 138
 None
 1.35A 2y69P-4x8qA:
undetectable
2y69W-4x8qA:
undetectable		 2y69P-4x8qA:
18.15
2y69W-4x8qA:
14.35
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.
4xmm NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		no annotation 4 PHE E 571
PHE E 640
LEU E 639
PHE E 562
 None
 1.33A 2y69P-4xmmE:
undetectable
2y69W-4xmmE:
undetectable		 2y69P-4xmmE:
13.88
2y69W-4xmmE:
5.82
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.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER

(Drosophila
melanogaster) 		PF00209
(SNF) 		4 PHE A 489
PHE A 106
LEU A 105
PHE A 590
 None
 1.00A 2y69P-4xnuA:
1.6
2y69W-4xnuA:
undetectable		 2y69P-4xnuA:
20.59
2y69W-4xnuA:
10.10
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.
4z0c TOLL-LIKE RECEPTOR
13

(Mus musculus) 		PF00560
(LRR_1)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 PHE A 488
PHE A 491
LEU A 467
PHE A 440
 None
 1.22A 2y69P-4z0cA:
undetectable
2y69W-4z0cA:
undetectable		 2y69P-4z0cA:
16.31
2y69W-4z0cA:
8.80
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 PHE A 159
PHE A 184
LEU A 163
PHE A 192
 None
 1.33A 2y69P-4z64A:
undetectable
2y69W-4z64A:
undetectable		 2y69P-4z64A:
17.27
2y69W-4z64A:
8.40
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		4 PHE A 328
PHE A 352
LEU A 332
PHE A 360
 None
 1.31A 2y69P-4z64A:
undetectable
2y69W-4z64A:
undetectable		 2y69P-4z64A:
17.27
2y69W-4z64A:
8.40
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.
5aff RIBOSOMAL PROTEIN
L11

(Chaetomium
thermophilum) 		PF00281
(Ribosomal_L5)
PF00673
(Ribosomal_L5_C) 		4 PHE C 128
PHE C 105
LEU C  92
PHE C 163
 None
 1.26A 2y69P-5affC:
undetectable
2y69W-5affC:
undetectable		 2y69P-5affC:
19.03
2y69W-5affC:
18.67
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		4 PHE A 463
PHE A 608
LEU A 604
PHE A 600
 None
 1.35A 2y69P-5azaA:
undetectable
2y69W-5azaA:
undetectable		 2y69P-5azaA:
13.40
2y69W-5azaA:
6.23
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.
5b0s LIN0857 PROTEIN

(Listeria
innocua) 		PF04041
(Glyco_hydro_130) 		4 PHE A 173
PHE A 127
LEU A 128
PHE A 131
 None
 1.36A 2y69P-5b0sA:
undetectable
2y69W-5b0sA:
undetectable		 2y69P-5b0sA:
18.41
2y69W-5b0sA:
14.33
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.
5b4s CHITOSANASE

(Mitsuaria
chitosanitabida) 		PF13647
(Glyco_hydro_80) 		4 PHE A  93
PHE A  85
LEU A 130
PHE A 123
 None
 0.76A 2y69P-5b4sA:
undetectable
2y69W-5b4sA:
undetectable		 2y69P-5b4sA:
22.65
2y69W-5b4sA:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bnn CAPSID PROTEIN VP1

(Enterovirus D) 		PF00073
(Rhv) 		4 PHE A  62
PHE A 110
LEU A 113
PHE A 115
 None
 1.36A 2y69P-5bnnA:
undetectable
2y69W-5bnnA:
undetectable		 2y69P-5bnnA:
20.92
2y69W-5bnnA:
14.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c17 MERB2

(Bacillus
megaterium) 		PF03243
(MerB) 		4 ARG A  65
PHE A 154
PHE A  10
LEU A  14
 None
DTV  A 303 (-3.0A)
DTV  A 303 ( 3.8A)
None
 1.35A 2y69P-5c17A:
undetectable
2y69W-5c17A:
undetectable		 2y69P-5c17A:
21.82
2y69W-5c17A:
18.93
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.
5czw MYROILYSIN

(Myroides
profundi) 		PF01400
(Astacin) 		4 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.22A 2y69P-5czwA:
undetectable
2y69W-5czwA:
undetectable		 2y69P-5czwA:
21.15
2y69W-5czwA:
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.
5e8y TGF-BETA RECEPTOR
TYPE-2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 PHE A 255
PHE A 279
LEU A 323
PHE A 294
 None
 1.09A 2y69P-5e8yA:
2.7
2y69W-5e8yA:
undetectable		 2y69P-5e8yA:
20.43
2y69W-5e8yA:
14.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ejj UFM1-SPECIFIC
PROTEASE

(Caenorhabditis
elegans) 		PF07910
(Peptidase_C78) 		4 ARG A 277
PHE A  47
PHE A  49
LEU A  80
 None
 1.24A 2y69P-5ejjA:
undetectable
2y69W-5ejjA:
undetectable		 2y69P-5ejjA:
20.36
2y69W-5ejjA:
10.02
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.
5f8v AMINOTRANSFERASE,
CLASS V FAMILY
PROTEIN

(Trichomonas
vaginalis) 		PF00266
(Aminotran_5) 		4 PHE A 327
PHE A 324
LEU A 336
PHE A   9
 None
 1.29A 2y69P-5f8vA:
undetectable
2y69W-5f8vA:
undetectable		 2y69P-5f8vA:
21.27
2y69W-5f8vA:
12.53
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.
5gx8 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Streptobacillus
moniliformis) 		PF13416
(SBP_bac_8) 		4 PHE A 201
PHE A 202
LEU A 273
PHE A 302
 None
 1.31A 2y69P-5gx8A:
3.0
2y69W-5gx8A:
undetectable		 2y69P-5gx8A:
20.67
2y69W-5gx8A:
12.59
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.
5hvm ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Aspergillus
fumigatus) 		PF00982
(Glyco_transf_20) 		4 PHE A 118
PHE A 100
LEU A 105
PHE A 109
 None
 1.34A 2y69P-5hvmA:
undetectable
2y69W-5hvmA:
undetectable		 2y69P-5hvmA:
18.38
2y69W-5hvmA:
11.45
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.
5ij6 LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		4 PHE A  84
PHE A  34
LEU A 206
PHE A 210
 None
 1.31A 2y69P-5ij6A:
undetectable
2y69W-5ij6A:
undetectable		 2y69P-5ij6A:
20.78
2y69W-5ij6A:
12.15
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.
5iy2 BETA-LACTAMASE
OXA-143

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		4 PHE A 182
PHE A 154
LEU A 172
PHE A 166
 None
 1.33A 2y69P-5iy2A:
undetectable
2y69W-5iy2A:
undetectable		 2y69P-5iy2A:
18.01
2y69W-5iy2A:
14.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5iy5 CYTOCHROME C OXIDASE
SUBUNIT 3

(Bos taurus) 		PF00510
(COX3) 		4 ARG C 156
PHE C 164
PHE C 219
LEU C 223
 CHD  C 307 (-4.0A)
CHD  C 307 (-3.9A)
None
None
 0.16A 2y69P-5iy5C:
37.3
2y69W-5iy5C:
undetectable		 2y69P-5iy5C:
100.00
2y69W-5iy5C:
15.35
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.
5j36 BEAK AND FEATHER
DISEASE VIRUS CAPSID
PROTEIN

(Beak and
feather disease
virus) 		no annotation 4 PHE E  58
PHE E  56
LEU E 231
PHE E  79
 None
 1.35A 2y69P-5j36E:
undetectable
2y69W-5j36E:
undetectable		 2y69P-5j36E:
21.11
2y69W-5j36E:
14.58
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.
5jk6 PHENYLALANINE-4-HYDR
OXYLASE

(Dictyostelium
discoideum) 		PF00351
(Biopterin_H) 		4 PHE A 290
PHE A 287
LEU A 282
PHE A 251
 None
 1.24A 2y69P-5jk6A:
undetectable
2y69W-5jk6A:
undetectable		 2y69P-5jk6A:
18.65
2y69W-5jk6A:
10.50
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.
5kdm MAJOR TEGUMENT
PROTEIN

(Human
gammaherpesvirus
4) 		PF12818
(Tegument_dsDNA) 		4 PHE D 500
PHE D 553
LEU D 551
PHE D 578
 None
 1.18A 2y69P-5kdmD:
undetectable
2y69W-5kdmD:
undetectable		 2y69P-5kdmD:
21.64
2y69W-5kdmD:
15.98
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.
5l01 TRYPTOPHAN
5-HYDROXYLASE 1

(Homo sapiens) 		PF00351
(Biopterin_H) 		4 PHE A 289
PHE A 286
LEU A 281
PHE A 250
 None
 1.30A 2y69P-5l01A:
undetectable
2y69W-5l01A:
undetectable		 2y69P-5l01A:
19.02
2y69W-5l01A:
12.79
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		4 PHE A 722
PHE A 723
LEU A 694
PHE A 692
 None
 0.99A 2y69P-5n6uA:
undetectable
2y69W-5n6uA:
undetectable		 2y69P-5n6uA:
14.23
2y69W-5n6uA:
6.61
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.
5oen INTERFERON
REGULATORY FACTOR 9

(Mus musculus) 		no annotation 4 PHE A 339
PHE A 322
LEU A 326
PHE A 330
 None
 0.81A 2y69P-5oenA:
undetectable
2y69W-5oenA:
undetectable		 2y69P-5oenA:
undetectable
2y69W-5oenA:
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.
5owg PCYX_EBK42635

(marine
metagenome) 		no annotation 4 ARG A  51
PHE A 218
LEU A 223
PHE A 224
 None
 1.22A 2y69P-5owgA:
undetectable
2y69W-5owgA:
undetectable		 2y69P-5owgA:
21.13
2y69W-5owgA:
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.
5ted LMO0488 PROTEIN

(Listeria
monocytogenes) 		no annotation 4 PHE B 287
PHE B 284
LEU B  95
PHE B  97
 None
 0.95A 2y69P-5tedB:
undetectable
2y69W-5tedB:
undetectable		 2y69P-5tedB:
20.60
2y69W-5tedB:
16.74
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.
5tpc BOTULINUM NEUROTOXIN
TYPE A

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 PHE A 945
PHE A1072
LEU A1074
PHE A 941
 None
 1.36A 2y69P-5tpcA:
undetectable
2y69W-5tpcA:
undetectable		 2y69P-5tpcA:
18.91
2y69W-5tpcA:
12.50
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.
5ugf PURINE NUCLEOSIDE
PHOSPHORYLASE

(Homo sapiens) 		PF01048
(PNP_UDP_1) 		4 PHE A  98
PHE A  56
LEU A  68
PHE A  70
 None
 1.18A 2y69P-5ugfA:
undetectable
2y69W-5ugfA:
undetectable		 2y69P-5ugfA:
24.48
2y69W-5ugfA:
14.15
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.
5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Paraburkholderia
xenovorans) 		PF00982
(Glyco_transf_20) 		4 PHE A 167
PHE A  98
LEU A  94
PHE A  89
 None
 1.04A 2y69P-5v0tA:
undetectable
2y69W-5v0tA:
undetectable		 2y69P-5v0tA:
20.08
2y69W-5v0tA:
10.91
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.
5voc ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
betaherpesvirus
5;
Human
betaherpesvirus
5) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C)
PF01801
(Cytomega_gL) 		4 PHE A  90
PHE A  80
LEU B 183
PHE B 222
 None
 1.19A 2y69P-5vocA:
2.6
2y69W-5vocA:
undetectable		 2y69P-5vocA:
15.48
2y69W-5vocA:
7.45
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.
5xwu LEUCINE-RICH REPEAT
AND FIBRONECTIN TYPE
III
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		no annotation 4 PHE B 157
PHE B 160
LEU B 136
PHE B 109
 None
 0.95A 2y69P-5xwuB:
undetectable
2y69W-5xwuB:
undetectable		 2y69P-5xwuB:
undetectable
2y69W-5xwuB:
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.
6b9g ATLASTIN-1

(Homo sapiens) 		no annotation 4 ARG B 113
PHE B  86
LEU B 107
PHE B 282
 None
 1.36A 2y69P-6b9gB:
undetectable
2y69W-6b9gB:
undetectable		 2y69P-6b9gB:
undetectable
2y69W-6b9gB:
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.
6c08 SODIUM-COUPLED
NEUTRAL AMINO ACID
TRANSPORTER 9

(Danio rerio) 		no annotation 4 ARG C 155
PHE C 507
LEU C 535
PHE C 531
 None
 1.07A 2y69P-6c08C:
3.8
2y69W-6c08C:
undetectable		 2y69P-6c08C:
undetectable
2y69W-6c08C:
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 4 PHE A3094
PHE A3056
LEU A3052
PHE A3039
 None
 1.32A 2y69P-6ez8A:
undetectable
2y69W-6ez8A:
undetectable		 2y69P-6ez8A:
undetectable
2y69W-6ez8A:
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.
6fwf NITRIC-OXIDE
REDUCTASE

(Neisseria
meningitidis) 		no annotation 4 PHE A 500
PHE A 347
LEU A 645
PHE A 597
 None
 1.33A 2y69P-6fwfA:
2.6
2y69W-6fwfA:
undetectable		 2y69P-6fwfA:
undetectable
2y69W-6fwfA:
undetectable