SIMILAR PATTERNS OF AMINO ACIDS FOR 5XDX_P_CHDP306

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.
1a75 PARVALBUMIN

(Merlangius
merlangus) 		PF13499
(EF-hand_7) 		4 ARG A  75
LEU A  67
PHE A  70
LEU A  77
 None
 1.19A 5xdxP-1a75A:
undetectable
5xdxW-1a75A:
undetectable		 5xdxP-1a75A:
14.45
5xdxW-1a75A:
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.
1bdg HEXOKINASE

(Schistosoma
mansoni) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 ARG A 321
PHE A  19
LEU A 319
PHE A 320
 None
 1.23A 5xdxP-1bdgA:
2.4
5xdxW-1bdgA:
0.0		 5xdxP-1bdgA:
19.11
5xdxW-1bdgA:
7.90
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.
1bix AP ENDONUCLEASE 1

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		4 LEU A 205
PHE A 165
LEU A 199
PHE A 195
 None
 1.04A 5xdxP-1bixA:
1.1
5xdxW-1bixA:
0.0		 5xdxP-1bixA:
18.33
5xdxW-1bixA:
14.65
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.
1cij PROTEIN (HALOALKANE
DEHALOGENASE)

(Xanthobacter
autotrophicus) 		PF00561
(Abhydrolase_1) 		4 LEU A 107
PHE A 105
LEU A 133
PHE A 141
 None
 1.14A 5xdxP-1cijA:
undetectable
5xdxW-1cijA:
0.0		 5xdxP-1cijA:
21.50
5xdxW-1cijA:
11.18
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.
1dvp HEPATOCYTE GROWTH
FACTOR-REGULATED
TYROSINE KINASE
SUBSTRATE

(Drosophila
melanogaster) 		PF00790
(VHS)
PF01363
(FYVE) 		4 LEU A  94
PHE A  90
LEU A 133
PHE A 140
 None
 1.27A 5xdxP-1dvpA:
0.5
5xdxW-1dvpA:
0.0		 5xdxP-1dvpA:
22.06
5xdxW-1dvpA:
15.58
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.
1f0x D-LACTATE
DEHYDROGENASE

(Escherichia
coli) 		PF01565
(FAD_binding_4)
PF09330
(Lact-deh-memb) 		4 LEU A  25
PHE A  51
LEU A  16
PHE A  12
 None
 1.18A 5xdxP-1f0xA:
undetectable
5xdxW-1f0xA:
0.0		 5xdxP-1f0xA:
17.74
5xdxW-1f0xA:
6.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jkw CYCLIN H

(Homo sapiens) 		PF00134
(Cyclin_N)
PF16899
(Cyclin_C_2) 		4 ARG A 102
LEU A 106
PHE A 110
LEU A 129
 None
 0.87A 5xdxP-1jkwA:
0.7
5xdxW-1jkwA:
0.0		 5xdxP-1jkwA:
20.23
5xdxW-1jkwA:
13.17
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.
1jqe HISTAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF13489
(Methyltransf_23) 		4 LEU A 244
PHE A 250
LEU A 182
PHE A 271
 None
 1.25A 5xdxP-1jqeA:
undetectable
5xdxW-1jqeA:
0.0		 5xdxP-1jqeA:
19.57
5xdxW-1jqeA:
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.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		4 LEU A 176
PHE A 155
LEU A 168
PHE A 160
 None
 1.28A 5xdxP-1og6A:
undetectable
5xdxW-1og6A:
0.0		 5xdxP-1og6A:
22.09
5xdxW-1og6A:
11.83
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.
1ogy PERIPLASMIC NITRATE
REDUCTASE

(Rhodobacter
sphaeroides) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 LEU A 569
PHE A 566
LEU A 135
PHE A 140
 None
 1.19A 5xdxP-1ogyA:
0.0
5xdxW-1ogyA:
undetectable		 5xdxP-1ogyA:
14.77
5xdxW-1ogyA:
6.79
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.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN

(Wolinella
succinogenes;
Wolinella
succinogenes) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF13085
(Fer2_3)
PF13183
(Fer4_8) 		4 ARG B 136
LEU A 135
LEU A 653
PHE A 131
 None
 1.23A 5xdxP-1qlbB:
undetectable
5xdxW-1qlbB:
undetectable		 5xdxP-1qlbB:
20.89
5xdxW-1qlbB:
11.49
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.
1u8v GAMMA-AMINOBUTYRATE
METABOLISM
DEHYDRATASE/ISOMERAS
E

(Clostridium
aminobutyricum) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		4 ARG A 433
LEU A 437
LEU A 391
PHE A 422
 None
 0.98A 5xdxP-1u8vA:
3.8
5xdxW-1u8vA:
undetectable		 5xdxP-1u8vA:
19.61
5xdxW-1u8vA:
8.93
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.
1wj9 CRISPR-ASSOCIATED
PROTEIN

(Thermus
thermophilus) 		PF08798
(CRISPR_assoc) 		4 LEU A 137
PHE A 135
LEU A 126
PHE A 176
 None
 1.22A 5xdxP-1wj9A:
undetectable
5xdxW-1wj9A:
undetectable		 5xdxP-1wj9A:
22.38
5xdxW-1wj9A:
10.90
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.
1x2b PROLINE
IMINOPEPTIDASE

(Serratia
marcescens) 		PF00561
(Abhydrolase_1) 		4 LEU A 242
PHE A 241
LEU A 141
PHE A 139
 None
None
None
STX  A 401 ( 4.7A)
 1.24A 5xdxP-1x2bA:
undetectable
5xdxW-1x2bA:
undetectable		 5xdxP-1x2bA:
20.40
5xdxW-1x2bA:
9.15
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.
1yir NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE 2

(Pseudomonas
aeruginosa) 		PF04095
(NAPRTase) 		4 LEU A  75
PHE A  77
LEU A  92
PHE A  88
 None
 1.23A 5xdxP-1yirA:
undetectable
5xdxW-1yirA:
undetectable		 5xdxP-1yirA:
21.34
5xdxW-1yirA:
10.08
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.
1yw6 SUCCINYLGLUTAMATE
DESUCCINYLASE

(Escherichia
coli) 		PF04952
(AstE_AspA) 		4 LEU A 184
PHE A 158
LEU A 176
PHE A 172
 None
 0.93A 5xdxP-1yw6A:
undetectable
5xdxW-1yw6A:
undetectable		 5xdxP-1yw6A:
20.30
5xdxW-1yw6A:
11.73
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.
2bec CALCINEURIN B
HOMOLOGOUS PROTEIN 2

(Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		4 ARG A 112
LEU A 116
PHE A 120
LEU A 181
 None
 1.02A 5xdxP-2becA:
undetectable
5xdxW-2becA:
undetectable		 5xdxP-2becA:
24.71
5xdxW-2becA:
12.38
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.
2e5h ZINC FINGER
CCHC-TYPE AND
RNA-BINDING
MOTIF-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1) 		4 LEU A  21
PHE A  19
LEU A  26
PHE A  30
 None
 1.26A 5xdxP-2e5hA:
undetectable
5xdxW-2e5hA:
undetectable		 5xdxP-2e5hA:
14.64
5xdxW-2e5hA:
20.21
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.
2ghb MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13416
(SBP_bac_8) 		4 LEU A 103
PHE A  97
LEU A  86
PHE A  83
 None
 1.11A 5xdxP-2ghbA:
undetectable
5xdxW-2ghbA:
undetectable		 5xdxP-2ghbA:
19.68
5xdxW-2ghbA:
9.45
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.
2iop CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 LEU A 601
PHE A 614
LEU A 597
PHE A 568
 None
 1.27A 5xdxP-2iopA:
undetectable
5xdxW-2iopA:
undetectable		 5xdxP-2iopA:
16.67
5xdxW-2iopA:
8.76
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.
2ivd PROTOPORPHYRINOGEN
OXIDASE

(Myxococcus
xanthus) 		PF01593
(Amino_oxidase) 		4 ARG A 193
LEU A 197
LEU A 131
PHE A 132
 GOL  A1468 (-4.3A)
GOL  A1468 (-4.6A)
None
None
 1.20A 5xdxP-2ivdA:
undetectable
5xdxW-2ivdA:
undetectable		 5xdxP-2ivdA:
18.12
5xdxW-2ivdA:
9.58
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.
2jek RV1873

(Mycobacterium
tuberculosis) 		PF08837
(DUF1810) 		4 LEU A 125
PHE A 122
LEU A 105
PHE A  97
 None
 1.04A 5xdxP-2jekA:
undetectable
5xdxW-2jekA:
undetectable		 5xdxP-2jekA:
19.12
5xdxW-2jekA:
15.79
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.
2jfd FATTY ACID SYNTHASE

(Homo sapiens) 		PF00698
(Acyl_transf_1)
PF16197
(KAsynt_C_assoc) 		4 LEU A 793
PHE A 795
LEU A 510
PHE A 516
 None
 1.25A 5xdxP-2jfdA:
undetectable
5xdxW-2jfdA:
undetectable		 5xdxP-2jfdA:
21.13
5xdxW-2jfdA:
7.97
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.
2jjy ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		4 LEU A  60
PHE A  37
LEU A  73
PHE A  74
 None
 1.18A 5xdxP-2jjyA:
undetectable
5xdxW-2jjyA:
undetectable		 5xdxP-2jjyA:
20.88
5xdxW-2jjyA:
19.89
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.
2lqn CRK-LIKE PROTEIN

(Homo sapiens) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07653
(SH3_2) 		4 LEU A  84
PHE A  71
LEU A  85
PHE A  36
 None
 1.09A 5xdxP-2lqnA:
undetectable
5xdxW-2lqnA:
undetectable		 5xdxP-2lqnA:
19.23
5xdxW-2lqnA:
12.20
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.
2nr4 CONSERVED
HYPOTHETICAL PROTEIN

(Methanosarcina
mazei) 		PF04289
(DUF447) 		4 LEU A  85
PHE A  86
LEU A  94
PHE A  99
 None
 1.14A 5xdxP-2nr4A:
2.4
5xdxW-2nr4A:
undetectable		 5xdxP-2nr4A:
22.61
5xdxW-2nr4A:
12.44
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.
2opt ACTII PROTEIN

(Streptomyces
coelicolor) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		4 ARG A  75
LEU A  79
PHE A  83
LEU A  49
 None
 0.71A 5xdxP-2optA:
2.9
5xdxW-2optA:
undetectable		 5xdxP-2optA:
23.21
5xdxW-2optA:
12.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pyu INOSINE TRIPHOSPHATE
PYROPHOSPHATASE RDGB

(Escherichia
coli) 		PF01725
(Ham1p_like) 		4 ARG A 126
LEU A  -6
PHE A  24
LEU A 134
 None
 1.09A 5xdxP-2pyuA:
undetectable
5xdxW-2pyuA:
undetectable		 5xdxP-2pyuA:
21.27
5xdxW-2pyuA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q2r GLUCOKINASE 1,
PUTATIVE

(Trypanosoma
cruzi) 		PF02685
(Glucokinase) 		4 ARG A  83
LEU A  24
PHE A  26
LEU A  15
 None
 1.04A 5xdxP-2q2rA:
undetectable
5xdxW-2q2rA:
undetectable		 5xdxP-2q2rA:
21.58
5xdxW-2q2rA:
10.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qhp FRUCTOKINASE

(Bacteroides
thetaiotaomicron) 		PF00294
(PfkB) 		4 LEU A 208
PHE A 223
LEU A 174
PHE A 168
 None
None
None
EDO  A 298 ( 4.9A)
 1.18A 5xdxP-2qhpA:
undetectable
5xdxW-2qhpA:
undetectable		 5xdxP-2qhpA:
21.17
5xdxW-2qhpA:
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.
2w2g NON-STRUCTURAL
PROTEIN 3

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF11633
(SUD-M) 		4 LEU A 421
PHE A 414
LEU A 437
PHE A 436
 None
 1.25A 5xdxP-2w2gA:
undetectable
5xdxW-2w2gA:
undetectable		 5xdxP-2w2gA:
22.53
5xdxW-2w2gA:
13.46
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.
2wch GENERAL
ODORANT-BINDING
PROTEIN 1

(Bombyx mori) 		PF01395
(PBP_GOBP) 		4 ARG A  20
LEU A  16
PHE A  12
LEU A  30
 None
None
B7M  A1145 (-3.7A)
None
 1.22A 5xdxP-2wchA:
undetectable
5xdxW-2wchA:
undetectable		 5xdxP-2wchA:
17.72
5xdxW-2wchA:
16.92
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.
2xgo XCOGT

(Xanthomonas
campestris) 		PF13432
(TPR_16)
PF13844
(Glyco_transf_41) 		4 ARG A 532
LEU A 536
PHE A 543
LEU A 501
 None
 1.09A 5xdxP-2xgoA:
undetectable
5xdxW-2xgoA:
undetectable		 5xdxP-2xgoA:
16.75
5xdxW-2xgoA:
7.00
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.
2xn6 THYROXINE-BINDING
GLOBULIN

(Homo sapiens) 		PF00079
(Serpin) 		4 LEU A 180
PHE A 349
LEU A  60
PHE A 315
 None
 1.11A 5xdxP-2xn6A:
undetectable
5xdxW-2xn6A:
undetectable		 5xdxP-2xn6A:
20.89
5xdxW-2xn6A:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xsw 72 KDA INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		4 ARG A 557
PHE A 523
LEU A 510
PHE A 480
 None
 1.17A 5xdxP-2xswA:
undetectable
5xdxW-2xswA:
undetectable		 5xdxP-2xswA:
22.16
5xdxW-2xswA:
10.08
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.
2y4l MANNOSYLGLYCERATE
SYNTHASE

(Rhodothermus
marinus) 		no annotation 4 LEU A 343
PHE A 341
LEU A 301
PHE A 312
 None
 1.25A 5xdxP-2y4lA:
undetectable
5xdxW-2y4lA:
undetectable		 5xdxP-2y4lA:
23.16
5xdxW-2y4lA:
8.53
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.
2yu6 YTH
DOMAIN-CONTAINING
PROTEIN 2

(Homo sapiens) 		PF04146
(YTH) 		4 LEU A  40
PHE A  44
LEU A  52
PHE A  54
 None
 1.09A 5xdxP-2yu6A:
undetectable
5xdxW-2yu6A:
undetectable		 5xdxP-2yu6A:
18.63
5xdxW-2yu6A:
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.
2z66 VARIABLE LYMPHOCYTE
RECEPTOR B,
TOLL-LIKE RECEPTOR 4

(Eptatretus
burgeri;
Homo sapiens) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		4 LEU A 424
PHE A 443
LEU A 404
PHE A 396
 None
 1.18A 5xdxP-2z66A:
undetectable
5xdxW-2z66A:
undetectable		 5xdxP-2z66A:
21.77
5xdxW-2z66A:
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.
3b86 GENERAL
ODORANT-BINDING
PROTEIN LUSH

(Drosophila
melanogaster) 		PF01395
(PBP_GOBP) 		4 LEU A  44
PHE A  21
LEU A  31
PHE A  36
 None
 1.00A 5xdxP-3b86A:
undetectable
5xdxW-3b86A:
undetectable		 5xdxP-3b86A:
17.27
5xdxW-3b86A:
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.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		4 ARG A 144
LEU A 151
PHE A 152
LEU A 266
 None
 1.21A 5xdxP-3cttA:
undetectable
5xdxW-3cttA:
undetectable		 5xdxP-3cttA:
14.59
5xdxW-3cttA:
5.12
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.
3evz METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF05175
(MTS) 		4 LEU A 202
PHE A 153
LEU A 186
PHE A 182
 None
 1.05A 5xdxP-3evzA:
undetectable
5xdxW-3evzA:
undetectable		 5xdxP-3evzA:
19.49
5xdxW-3evzA:
16.67
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.
3ewe NUCLEOPORIN NUP85

(Saccharomyces
cerevisiae) 		PF07575
(Nucleopor_Nup85) 		4 LEU B 362
PHE B 360
LEU B 208
PHE B 204
 None
 1.25A 5xdxP-3eweB:
2.8
5xdxW-3eweB:
undetectable		 5xdxP-3eweB:
19.52
5xdxW-3eweB:
7.80
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.
3exn PROBABLE
ACETYLTRANSFERASE

(Thermus
thermophilus) 		PF00583
(Acetyltransf_1) 		4 LEU A  63
PHE A  62
LEU A  22
PHE A  26
 None
 0.92A 5xdxP-3exnA:
undetectable
5xdxW-3exnA:
undetectable		 5xdxP-3exnA:
23.11
5xdxW-3exnA:
19.20
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.
3fvq FE(3+) IONS IMPORT
ATP-BINDING PROTEIN
FBPC

(Neisseria
gonorrhoeae) 		PF00005
(ABC_tran) 		4 ARG A 208
LEU A  33
PHE A 194
LEU A  27
 None
 1.25A 5xdxP-3fvqA:
undetectable
5xdxW-3fvqA:
undetectable		 5xdxP-3fvqA:
21.04
5xdxW-3fvqA:
11.85
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.
3gcf TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE
1,9A-DIOXYGENASE

(Nocardioides
aromaticivorans) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		4 LEU A 284
PHE A 279
LEU A 304
PHE A 321
 None
 1.06A 5xdxP-3gcfA:
undetectable
5xdxW-3gcfA:
undetectable		 5xdxP-3gcfA:
18.75
5xdxW-3gcfA:
10.99
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.
3gse MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Yersinia pestis) 		PF00425
(Chorismate_bind) 		4 ARG A 129
LEU A 143
PHE A  30
LEU A 145
 None
None
SO4  A 457 ( 4.6A)
None
 1.27A 5xdxP-3gseA:
undetectable
5xdxW-3gseA:
undetectable		 5xdxP-3gseA:
20.10
5xdxW-3gseA:
9.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gzg MOLYBDATE-BINDING
PERIPLASMIC PROTEIN
PERMEASE

(Xanthomonas
citri) 		PF13531
(SBP_bac_11) 		4 LEU A  80
PHE A 230
LEU A 216
PHE A 212
 None
 0.98A 5xdxP-3gzgA:
undetectable
5xdxW-3gzgA:
undetectable		 5xdxP-3gzgA:
23.84
5xdxW-3gzgA:
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.
3ju5 ARGININE KINASE

(Apostichopus
japonicus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		4 LEU A  79
PHE A  76
LEU A  25
PHE A  18
 None
 1.12A 5xdxP-3ju5A:
undetectable
5xdxW-3ju5A:
undetectable		 5xdxP-3ju5A:
20.16
5xdxW-3ju5A:
10.67
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.
3k1t GLUTAMATE--CYSTEINE
LIGASE GSHA

(Methylobacillus
flagellatus) 		PF08886
(GshA) 		4 ARG A 400
LEU A  14
PHE A  54
LEU A   6
 None
 1.22A 5xdxP-3k1tA:
undetectable
5xdxW-3k1tA:
undetectable		 5xdxP-3k1tA:
22.30
5xdxW-3k1tA:
10.36
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.
3k70 EXODEOXYRIBONUCLEASE
V BETA CHAIN

(Escherichia
coli) 		PF00580
(UvrD-helicase)
PF12705
(PDDEXK_1)
PF13361
(UvrD_C) 		4 LEU B  59
PHE B 378
LEU B  54
PHE B  50
 None
 1.29A 5xdxP-3k70B:
undetectable
5xdxW-3k70B:
undetectable		 5xdxP-3k70B:
12.40
5xdxW-3k70B:
4.57
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.
3lpp SUCRASE-ISOMALTASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		4 ARG A 172
LEU A 179
PHE A 180
LEU A 294
 None
 1.25A 5xdxP-3lppA:
undetectable
5xdxW-3lppA:
undetectable		 5xdxP-3lppA:
13.92
5xdxW-3lppA:
5.19
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		4 LEU A 214
PHE A 218
LEU A  24
PHE A  66
 None
 1.09A 5xdxP-3m07A:
undetectable
5xdxW-3m07A:
undetectable		 5xdxP-3m07A:
16.69
5xdxW-3m07A:
6.43
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria sp.
TM1040) 		PF03070
(TENA_THI-4) 		4 LEU A 204
PHE A 208
LEU A 187
PHE A 195
 None
None
None
EDO  A 231 (-3.8A)
 0.99A 5xdxP-3mvuA:
undetectable
5xdxW-3mvuA:
undetectable		 5xdxP-3mvuA:
20.37
5xdxW-3mvuA:
14.75
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.
3n0l SERINE
HYDROXYMETHYLTRANSFE
RASE

(Campylobacter
jejuni) 		PF00464
(SHMT) 		4 LEU A 273
PHE A 271
LEU A  80
PHE A  81
 None
 1.28A 5xdxP-3n0lA:
undetectable
5xdxW-3n0lA:
undetectable		 5xdxP-3n0lA:
19.62
5xdxW-3n0lA:
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.
3nk4 ZONA PELLUCIDA 3

(Gallus gallus) 		PF00100
(Zona_pellucida) 		4 LEU A 208
PHE A 276
LEU A 188
PHE A 199
 None
 1.26A 5xdxP-3nk4A:
undetectable
5xdxW-3nk4A:
undetectable		 5xdxP-3nk4A:
21.75
5xdxW-3nk4A:
11.65
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.
3q8i ODORANT BINDING
PROTEIN

(Anopheles
gambiae) 		PF01395
(PBP_GOBP) 		4 LEU A  44
PHE A  21
LEU A  31
PHE A  36
 None
 1.01A 5xdxP-3q8iA:
undetectable
5xdxW-3q8iA:
undetectable		 5xdxP-3q8iA:
21.23
5xdxW-3q8iA:
21.24
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.
3qrq PUTATIVE
UNCHARACTERIZED
PROTEIN TTHB192

(Thermus
thermophilus) 		PF08798
(CRISPR_assoc) 		4 LEU A 137
PHE A 135
LEU A 126
PHE A 176
 None
 1.22A 5xdxP-3qrqA:
undetectable
5xdxW-3qrqA:
undetectable		 5xdxP-3qrqA:
21.71
5xdxW-3qrqA:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rd5 MYPAA.01249.C

(Mycobacterium
avium) 		PF00106
(adh_short) 		4 ARG A 131
LEU A 191
PHE A 246
LEU A 241
 None
 0.98A 5xdxP-3rd5A:
undetectable
5xdxW-3rd5A:
undetectable		 5xdxP-3rd5A:
20.90
5xdxW-3rd5A:
12.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t3o METAL DEPENDENT
HYDROLASE

(Thermus
thermophilus) 		PF07521
(RMMBL)
PF12706
(Lactamase_B_2) 		4 LEU A 145
PHE A 146
LEU A 143
PHE A  35
 None
 1.27A 5xdxP-3t3oA:
undetectable
5xdxW-3t3oA:
undetectable		 5xdxP-3t3oA:
17.11
5xdxW-3t3oA:
8.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a8e PROBABLE TYROSINE
RECOMBINASE
XERC-LIKE

(Pyrococcus
abyssi) 		PF00589
(Phage_integrase)
PF02899
(Phage_int_SAM_1) 		4 ARG A 184
LEU A 181
LEU A 191
PHE A 192
 None
 0.98A 5xdxP-4a8eA:
undetectable
5xdxW-4a8eA:
undetectable		 5xdxP-4a8eA:
17.88
5xdxW-4a8eA:
12.25
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.
4c0g CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 3

(Homo sapiens) 		PF04153
(NOT2_3_5) 		4 LEU A 671
PHE A 673
LEU A 666
PHE A 662
 None
 1.13A 5xdxP-4c0gA:
undetectable
5xdxW-4c0gA:
undetectable		 5xdxP-4c0gA:
19.83
5xdxW-4c0gA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e1e FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
cruzi) 		PF00348
(polyprenyl_synt) 		4 LEU A 215
PHE A 210
LEU A 155
PHE A 222
 None
 1.06A 5xdxP-4e1eA:
2.3
5xdxW-4e1eA:
undetectable		 5xdxP-4e1eA:
20.44
5xdxW-4e1eA:
10.92
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.
4f8a POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY H
MEMBER 1

(Mus musculus) 		PF00027
(cNMP_binding) 		4 LEU A 697
PHE A 644
LEU A 695
PHE A 691
 None
 1.23A 5xdxP-4f8aA:
undetectable
5xdxW-4f8aA:
undetectable		 5xdxP-4f8aA:
19.16
5xdxW-4f8aA:
18.59
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.
4fd0 LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
caccae) 		PF07523
(Big_3)
PF13306
(LRR_5) 		4 LEU A 300
PHE A 272
LEU A 323
PHE A 332
 None
 1.13A 5xdxP-4fd0A:
undetectable
5xdxW-4fd0A:
undetectable		 5xdxP-4fd0A:
20.25
5xdxW-4fd0A:
8.48
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.
4fdw LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF07523
(Big_3)
PF13306
(LRR_5) 		4 LEU A 300
PHE A 272
LEU A 323
PHE A 332
 None
 1.11A 5xdxP-4fdwA:
undetectable
5xdxW-4fdwA:
undetectable		 5xdxP-4fdwA:
19.95
5xdxW-4fdwA:
11.36
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.
4flx DNA POLYMERASE 1

(Pyrococcus
abyssi) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 ARG A 266
LEU A 352
PHE A 356
LEU A 333
 ARG  A 266 ( 0.6A)
LEU  A 352 ( 0.6A)
PHE  A 356 ( 1.3A)
LEU  A 333 ( 0.6A)
 0.95A 5xdxP-4flxA:
2.6
5xdxW-4flxA:
undetectable		 5xdxP-4flxA:
13.37
5xdxW-4flxA:
6.62
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.
4iua HEPATOCYTE GROWTH
FACTOR

(Mus musculus) 		PF00024
(PAN_1)
PF00051
(Kringle) 		4 LEU A 119
PHE A 117
LEU A  51
PHE A 102
 None
 1.28A 5xdxP-4iuaA:
undetectable
5xdxW-4iuaA:
undetectable		 5xdxP-4iuaA:
18.06
5xdxW-4iuaA:
13.72
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.
4j0m SERINE/THREONINE-PRO
TEIN KINASE
BRI1-LIKE 1

(Arabidopsis
thaliana) 		PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 LEU A 228
PHE A 230
LEU A 203
PHE A 199
 None
 1.02A 5xdxP-4j0mA:
undetectable
5xdxW-4j0mA:
undetectable		 5xdxP-4j0mA:
16.15
5xdxW-4j0mA:
5.59
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.
4lmo TELOMERASE REVERSE
TRANSCRIPTASE

(Takifugu
rubripes) 		PF12009
(Telomerase_RBD) 		4 LEU A 370
PHE A 366
LEU A 315
PHE A 313
 None
 1.27A 5xdxP-4lmoA:
undetectable
5xdxW-4lmoA:
undetectable		 5xdxP-4lmoA:
20.14
5xdxW-4lmoA:
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.
4lnq INTERFERON-ACTIVABLE
PROTEIN 202

(Mus musculus) 		PF02760
(HIN) 		4 LEU A 218
PHE A 239
LEU A 216
PHE A 188
 None
 1.12A 5xdxP-4lnqA:
undetectable
5xdxW-4lnqA:
undetectable		 5xdxP-4lnqA:
20.00
5xdxW-4lnqA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mjf HYPOTHETICAL PROTEIN

(Bacteroides
vulgatus) 		PF14254
(DUF4348) 		4 LEU A 201
PHE A 203
LEU A 278
PHE A 186
 CL  A 311 ( 4.6A)
None
None
None
 1.18A 5xdxP-4mjfA:
undetectable
5xdxW-4mjfA:
undetectable		 5xdxP-4mjfA:
20.61
5xdxW-4mjfA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Bacillus
anthracis) 		PF04551
(GcpE) 		4 ARG D   7
LEU D  26
LEU D 226
PHE D 256
 None
 1.26A 5xdxP-4mwaD:
undetectable
5xdxW-4mwaD:
undetectable		 5xdxP-4mwaD:
21.78
5xdxW-4mwaD:
11.91
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.
4nt4 GILGAMESH, ISOFORM I

(Drosophila
melanogaster) 		PF00069
(Pkinase) 		4 ARG A 298
LEU A 294
PHE A 290
LEU A 282
 None
 1.18A 5xdxP-4nt4A:
2.4
5xdxW-4nt4A:
undetectable		 5xdxP-4nt4A:
22.15
5xdxW-4nt4A:
14.68
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.
4ol8 REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H

(Saccharomyces
cerevisiae) 		PF00078
(RVT_1) 		4 LEU A 368
PHE A 384
LEU A 416
PHE A 421
 None
 1.10A 5xdxP-4ol8A:
undetectable
5xdxW-4ol8A:
undetectable		 5xdxP-4ol8A:
17.73
5xdxW-4ol8A:
9.90
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.
4pfw ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		4 ARG A 296
LEU A 506
PHE A 508
LEU A 503
 None
 0.92A 5xdxP-4pfwA:
undetectable
5xdxW-4pfwA:
undetectable		 5xdxP-4pfwA:
18.96
5xdxW-4pfwA:
6.76
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.
4pmz XYLANASE

(Xanthomonas
citri) 		PF00331
(Glyco_hydro_10) 		4 LEU A 303
PHE A 290
LEU A 317
PHE A 273
 None
 1.20A 5xdxP-4pmzA:
undetectable
5xdxW-4pmzA:
undetectable		 5xdxP-4pmzA:
22.22
5xdxW-4pmzA:
10.88
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.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		4 LEU A 139
PHE A 135
LEU A 154
PHE A 149
 None
 1.17A 5xdxP-4po0A:
undetectable
5xdxW-4po0A:
undetectable		 5xdxP-4po0A:
16.24
5xdxW-4po0A:
7.43
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.
4qbu ZMAA

(Bacillus cereus) 		PF00698
(Acyl_transf_1) 		4 LEU A 412
PHE A 411
LEU A 113
PHE A 120
 None
 1.22A 5xdxP-4qbuA:
undetectable
5xdxW-4qbuA:
undetectable		 5xdxP-4qbuA:
19.91
5xdxW-4qbuA:
10.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u7t DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 3A

(Homo sapiens) 		PF00145
(DNA_methylase) 		4 ARG A 488
LEU A 479
PHE A 475
LEU A 500
 None
 1.17A 5xdxP-4u7tA:
undetectable
5xdxW-4u7tA:
undetectable		 5xdxP-4u7tA:
19.46
5xdxW-4u7tA:
9.32
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.
4x3m RNA 2'-O RIBOSE
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF00588
(SpoU_methylase) 		4 ARG A 221
LEU A 183
PHE A 205
LEU A 176
 None
 1.24A 5xdxP-4x3mA:
undetectable
5xdxW-4x3mA:
undetectable		 5xdxP-4x3mA:
20.79
5xdxW-4x3mA:
11.02
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.
4xt1 G-PROTEIN COUPLED
RECEPTOR HOMOLOG
US28

(Cytomegalovirus) 		PF00001
(7tm_1) 		4 LEU A 306
PHE A 309
LEU A 302
PHE A 293
 None
None
None
OLC  A 405 (-3.9A)
 1.16A 5xdxP-4xt1A:
0.0
5xdxW-4xt1A:
undetectable		 5xdxP-4xt1A:
20.61
5xdxW-4xt1A:
12.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y0m OXYR

(Pseudomonas
aeruginosa) 		PF03466
(LysR_substrate) 		4 ARG A 231
LEU A 243
PHE A 165
LEU A 227
 None
 1.29A 5xdxP-4y0mA:
undetectable
5xdxW-4y0mA:
undetectable		 5xdxP-4y0mA:
22.30
5xdxW-4y0mA:
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.
4zaj ARGININE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 ARG A 261
LEU A 163
PHE A 126
LEU A 161
 None
 1.25A 5xdxP-4zajA:
2.5
5xdxW-4zajA:
undetectable		 5xdxP-4zajA:
16.86
5xdxW-4zajA:
8.91
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.
5do7 ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
5

(Homo sapiens) 		PF00005
(ABC_tran)
PF01061
(ABC2_membrane) 		4 LEU A 441
PHE A 442
LEU A 379
PHE A 474
 None
 1.23A 5xdxP-5do7A:
3.3
5xdxW-5do7A:
undetectable		 5xdxP-5do7A:
16.67
5xdxW-5do7A:
6.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eov 16S/23S RRNA
(CYTIDINE-2'-O)-METH
YLTRANSFERASE TLYA

(Mycobacterium
tuberculosis) 		PF01728
(FtsJ) 		4 LEU A  74
PHE A  77
LEU A  70
PHE A  96
 None
 1.27A 5xdxP-5eovA:
undetectable
5xdxW-5eovA:
undetectable		 5xdxP-5eovA:
22.92
5xdxW-5eovA:
17.98
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.
5fn3 PRESENILIN-1

(Homo sapiens) 		PF01080
(Presenilin) 		4 LEU B 392
PHE B 388
LEU B 443
PHE B 447
 None
 0.99A 5xdxP-5fn3B:
2.1
5xdxW-5fn3B:
undetectable		 5xdxP-5fn3B:
20.04
5xdxW-5fn3B:
7.86
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.
5fu6 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 3

(Homo sapiens) 		PF04153
(NOT2_3_5) 		4 LEU C 671
PHE C 673
LEU C 666
PHE C 662
 None
 0.98A 5xdxP-5fu6C:
undetectable
5xdxW-5fu6C:
undetectable		 5xdxP-5fu6C:
19.03
5xdxW-5fu6C:
16.79
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 LEU A 879
PHE A 883
LEU A 860
PHE A 845
 None
 1.22A 5xdxP-5i6iA:
undetectable
5xdxW-5i6iA:
undetectable		 5xdxP-5i6iA:
7.86
5xdxW-5i6iA:
2.27
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
LEU C 160
PHE C 164
LEU C 223
 CHD  C 307 (-4.0A)
CHD  C 307 ( 3.9A)
CHD  C 307 (-3.9A)
None
 0.15A 5xdxP-5iy5C:
37.5
5xdxW-5iy5C:
undetectable		 5xdxP-5iy5C:
100.00
5xdxW-5iy5C:
10.36
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.
5jxu DYP-TYPE PEROXIDASE
FAMILY

(Thermomonospora
curvata) 		PF04261
(Dyp_perox) 		4 LEU A  75
PHE A 189
LEU A 163
PHE A 125
 None
 1.14A 5xdxP-5jxuA:
undetectable
5xdxW-5jxuA:
undetectable		 5xdxP-5jxuA:
20.25
5xdxW-5jxuA:
10.06
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.
5k04 UNCHARACTERIZED
PROTEIN

(Candida
albicans) 		PF09797
(NatB_MDM20) 		4 ARG A 138
LEU A 142
PHE A 146
PHE A 177
 None
 1.07A 5xdxP-5k04A:
1.0
5xdxW-5k04A:
undetectable		 5xdxP-5k04A:
16.04
5xdxW-5k04A:
7.61
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.
5k7l POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY H
MEMBER 1

(Rattus
norvegicus) 		PF00027
(cNMP_binding)
PF00520
(Ion_trans)
PF13426
(PAS_9) 		4 LEU A 670
PHE A 617
LEU A 668
PHE A 664
 None
 1.21A 5xdxP-5k7lA:
2.3
5xdxW-5k7lA:
undetectable		 5xdxP-5k7lA:
14.86
5xdxW-5k7lA:
6.02
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.
5nv8 EF-P ARGININE 32
RHAMNOSYL-TRANSFERAS
E

(Pseudomonas
putida) 		PF10093
(DUF2331) 		4 LEU A 250
PHE A 252
LEU A 177
PHE A 173
 None
TRH  A 401 (-3.6A)
None
None
 1.28A 5xdxP-5nv8A:
undetectable
5xdxW-5nv8A:
undetectable		 5xdxP-5nv8A:
18.59
5xdxW-5nv8A:
11.90
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.
5ue7 PHOSPHOMANNOMUTASE

(Candida
albicans) 		PF03332
(PMM) 		4 LEU A  14
PHE A  47
LEU A  12
PHE A 205
 None
 1.18A 5xdxP-5ue7A:
undetectable
5xdxW-5ue7A:
undetectable		 5xdxP-5ue7A:
18.57
5xdxW-5ue7A:
12.90
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.
5ulu CADHERIN-23

(Mus musculus) 		no annotation 4 LEU A2032
PHE A2033
LEU A1955
PHE A1987
 None
 1.22A 5xdxP-5uluA:
undetectable
5xdxW-5uluA:
undetectable		 5xdxP-5uluA:
undetectable
5xdxW-5uluA:
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.
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 LEU B 221
PHE B 222
LEU A 106
PHE B 174
 None
 1.17A 5xdxP-5vocB:
undetectable
5xdxW-5vocB:
undetectable		 5xdxP-5vocB:
18.21
5xdxW-5vocB:
13.95
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.
5xmc E3 UBIQUITIN-PROTEIN
LIGASE ITCHY

(Mus musculus) 		PF00397
(WW)
PF00632
(HECT) 		4 LEU A 610
PHE A 611
LEU A 742
PHE A 734
 None
 1.15A 5xdxP-5xmcA:
undetectable
5xdxW-5xmcA:
undetectable		 5xdxP-5xmcA:
16.12
5xdxW-5xmcA:
5.38
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.
5xsx CHITINASE

(Thermococcus
chitonophagus) 		no annotation 4 LEU A 619
PHE A 518
LEU A 525
PHE A 569
 None
 1.18A 5xdxP-5xsxA:
undetectable
5xdxW-5xsxA:
undetectable		 5xdxP-5xsxA:
undetectable
5xdxW-5xsxA:
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 LEU C 435
PHE C 434
LEU C 418
PHE C 417
 None
 1.26A 5xdxP-6c08C:
3.9
5xdxW-6c08C:
undetectable		 5xdxP-6c08C:
undetectable
5xdxW-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.
6fb3 TENEURIN-2

(Gallus gallus) 		no annotation 4 ARG A2301
LEU A2298
PHE A2297
LEU A2450
 None
 1.26A 5xdxP-6fb3A:
undetectable
5xdxW-6fb3A:
undetectable		 5xdxP-6fb3A:
undetectable
5xdxW-6fb3A:
undetectable