SIMILAR PATTERNS OF AMINO ACIDS FOR 3ETE_C_H3PC552_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1all ALLOPHYCOCYANIN

(Arthrospira
platensis) 		PF00502
(Phycobilisome) 		3 TYR A  91
TYR A 168
GLY A 111
 CYC  A 175 (-4.2A)
None
CYC  A 175 ( 3.9A)
 0.69A 3eteB-1allA:
undetectable
3eteD-1allA:
undetectable
3eteF-1allA:
undetectable		 3eteB-1allA:
16.48
3eteD-1allA:
16.48
3eteF-1allA:
16.48
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.
1b33 ALLOPHYCOCYANIN,
ALPHA CHAIN

(Mastigocladus
laminosus) 		PF00502
(Phycobilisome) 		3 TYR A  87
TYR A 154
GLY A 107
 BLA  A 201 (-4.2A)
None
BLA  A 201 ( 4.0A)
 0.69A 3eteB-1b33A:
undetectable
3eteD-1b33A:
undetectable
3eteF-1b33A:
undetectable		 3eteB-1b33A:
18.24
3eteD-1b33A:
18.24
3eteF-1b33A:
18.24
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.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		3 TYR A 665
TYR A 433
GLY A 397
 None
FE  A 691 (-4.2A)
None
 0.64A 3eteB-1biyA:
undetectable
3eteD-1biyA:
undetectable
3eteF-1biyA:
undetectable		 3eteB-1biyA:
21.62
3eteD-1biyA:
21.62
3eteF-1biyA:
21.62
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.
1bs9 ACETYL XYLAN
ESTERASE

(Talaromyces
purpureogenus) 		PF01083
(Cutinase) 		3 TYR A  43
TYR A  57
GLY A  92
 None
 0.61A 3eteB-1bs9A:
2.1
3eteD-1bs9A:
2.2
3eteF-1bs9A:
2.1		 3eteB-1bs9A:
18.71
3eteD-1bs9A:
18.71
3eteF-1bs9A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		3 TYR A 108
TYR A 137
GLY A 210
 SAH  A 699 (-4.4A)
None
SAH  A 699 ( 4.4A)
 0.72A 3eteB-1dl5A:
undetectable
3eteD-1dl5A:
3.1
3eteF-1dl5A:
3.0		 3eteB-1dl5A:
21.86
3eteD-1dl5A:
21.86
3eteF-1dl5A:
21.86
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.
1e4e VANCOMYCIN/TEICOPLAN
IN A-TYPE RESISTANCE
PROTEIN VANA

(Enterococcus
faecium) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 TYR B 280
TYR B 318
GLY B 221
 None
 0.75A 3eteB-1e4eB:
2.6
3eteD-1e4eB:
3.4
3eteF-1e4eB:
3.4		 3eteB-1e4eB:
21.71
3eteD-1e4eB:
21.71
3eteF-1e4eB:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gt9 KUMAMOLYSIN

(Bacillus
subtilis) 		PF00082
(Peptidase_S8) 		3 TYR 1  15
TYR 1 263
GLY 1 255
 None
 0.67A 3eteB-1gt91:
undetectable
3eteD-1gt91:
undetectable
3eteF-1gt91:
undetectable		 3eteB-1gt91:
21.63
3eteD-1gt91:
21.63
3eteF-1gt91:
21.63
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.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		3 TYR A 323
TYR A  94
GLY A  64
 None
FE  A 702 ( 4.3A)
None
 0.62A 3eteB-1h76A:
2.0
3eteD-1h76A:
undetectable
3eteF-1h76A:
undetectable		 3eteB-1h76A:
21.46
3eteD-1h76A:
21.46
3eteF-1h76A:
21.46
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.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		3 TYR A 663
TYR A 431
GLY A 397
 None
FE  A 703 ( 4.2A)
None
 0.69A 3eteB-1h76A:
2.0
3eteD-1h76A:
undetectable
3eteF-1h76A:
undetectable		 3eteB-1h76A:
21.46
3eteD-1h76A:
21.46
3eteF-1h76A:
21.46
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.
1ii2 PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Trypanosoma
cruzi) 		PF01293
(PEPCK_ATP) 		3 TYR A 259
TYR A 116
GLY A 182
 None
 0.57A 3eteB-1ii2A:
undetectable
3eteD-1ii2A:
undetectable
3eteF-1ii2A:
undetectable		 3eteB-1ii2A:
23.87
3eteD-1ii2A:
23.87
3eteF-1ii2A:
23.87
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.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		3 TYR A 319
TYR A  95
GLY A  65
 None
FE  A 702 ( 4.2A)
None
 0.54A 3eteB-1jnfA:
undetectable
3eteD-1jnfA:
undetectable
3eteF-1jnfA:
undetectable		 3eteB-1jnfA:
21.51
3eteD-1jnfA:
21.51
3eteF-1jnfA:
21.51
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.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		3 TYR A 652
TYR A 425
GLY A 393
 None
FE  A 703 ( 4.1A)
None
 0.72A 3eteB-1jnfA:
undetectable
3eteD-1jnfA:
undetectable
3eteF-1jnfA:
undetectable		 3eteB-1jnfA:
21.51
3eteD-1jnfA:
21.51
3eteF-1jnfA:
21.51
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.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		3 TYR A 652
TYR A 425
GLY A 394
 None
FE  A 703 ( 4.1A)
None
 0.67A 3eteB-1jnfA:
undetectable
3eteD-1jnfA:
undetectable
3eteF-1jnfA:
undetectable		 3eteB-1jnfA:
21.51
3eteD-1jnfA:
21.51
3eteF-1jnfA:
21.51
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.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 TYR A 324
TYR A  92
GLY A  61
 None
FE  A 693 ( 4.2A)
None
 0.74A 3eteB-1n76A:
undetectable
3eteD-1n76A:
undetectable
3eteF-1n76A:
undetectable		 3eteB-1n76A:
21.70
3eteD-1n76A:
21.70
3eteF-1n76A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 TYR A 667
TYR A 435
GLY A 397
 None
FE  A 694 ( 4.1A)
None
 0.73A 3eteB-1n76A:
undetectable
3eteD-1n76A:
undetectable
3eteF-1n76A:
undetectable		 3eteB-1n76A:
21.70
3eteD-1n76A:
21.70
3eteF-1n76A:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oa3 ENDO-BETA-1-4-GLUCAN
ASE

(Trichoderma
citrinoviride) 		PF01670
(Glyco_hydro_12) 		3 TYR A 168
TYR A 195
GLY A 170
 None
 0.69A 3eteB-1oa3A:
undetectable
3eteD-1oa3A:
undetectable
3eteF-1oa3A:
undetectable		 3eteB-1oa3A:
18.99
3eteD-1oa3A:
18.99
3eteF-1oa3A:
18.99
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.
1ogo DEXTRANASE

(Talaromyces
minioluteus) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		3 TYR X 106
TYR X 137
GLY X 157
 None
 0.67A 3eteB-1ogoX:
undetectable
3eteD-1ogoX:
undetectable
3eteF-1ogoX:
undetectable		 3eteB-1ogoX:
23.19
3eteD-1ogoX:
23.19
3eteF-1ogoX:
23.19
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.
1qgc PROTEIN (VIRUS
CAPSID PROTEIN VP2)
PROTEIN (VIRUS
CAPSID PROTEIN VP3)

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 TYR 3 125
TYR 2 100
GLY 3 182
 None
 0.69A 3eteB-1qgc3:
undetectable
3eteD-1qgc3:
undetectable
3eteF-1qgc3:
undetectable		 3eteB-1qgc3:
18.70
3eteD-1qgc3:
18.70
3eteF-1qgc3:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		3 TYR A 324
TYR A  92
GLY A  61
 None
SM  A 690 ( 4.2A)
None
 0.75A 3eteB-1qjmA:
undetectable
3eteD-1qjmA:
undetectable
3eteF-1qjmA:
undetectable		 3eteB-1qjmA:
21.49
3eteD-1qjmA:
21.49
3eteF-1qjmA:
21.49
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.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		3 TYR A 324
TYR A  92
GLY A  62
 None
SM  A 690 ( 4.2A)
None
 0.68A 3eteB-1qjmA:
undetectable
3eteD-1qjmA:
undetectable
3eteF-1qjmA:
undetectable		 3eteB-1qjmA:
21.49
3eteD-1qjmA:
21.49
3eteF-1qjmA:
21.49
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.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		3 TYR A 665
TYR A 433
GLY A 396
 None
 0.62A 3eteB-1qjmA:
undetectable
3eteD-1qjmA:
undetectable
3eteF-1qjmA:
undetectable		 3eteB-1qjmA:
21.49
3eteD-1qjmA:
21.49
3eteF-1qjmA:
21.49
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.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		3 TYR A 665
TYR A 433
GLY A 397
 None
 0.74A 3eteB-1qjmA:
undetectable
3eteD-1qjmA:
undetectable
3eteF-1qjmA:
undetectable		 3eteB-1qjmA:
21.49
3eteD-1qjmA:
21.49
3eteF-1qjmA:
21.49
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.
1qoz ACETYL XYLAN
ESTERASE

(Trichoderma
reesei) 		PF01083
(Cutinase) 		3 TYR A  43
TYR A  57
GLY A  92
 None
 0.66A 3eteB-1qozA:
2.5
3eteD-1qozA:
2.3
3eteF-1qozA:
2.0		 3eteB-1qozA:
18.60
3eteD-1qozA:
18.60
3eteF-1qozA:
18.60
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.
1ryo SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 TYR A 319
TYR A  95
GLY A  65
 None
FE  A 329 ( 4.4A)
None
 0.70A 3eteB-1ryoA:
undetectable
3eteD-1ryoA:
undetectable
3eteF-1ryoA:
undetectable		 3eteB-1ryoA:
23.24
3eteD-1ryoA:
23.24
3eteF-1ryoA:
23.24
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.
1s4v CYSTEINE
ENDOPEPTIDASE

(Ricinus
communis) 		PF00112
(Peptidase_C1) 		3 TYR A  94
TYR A  89
GLY A  96
 None
 0.71A 3eteB-1s4vA:
undetectable
3eteD-1s4vA:
undetectable
3eteF-1s4vA:
undetectable		 3eteB-1s4vA:
19.16
3eteD-1s4vA:
19.16
3eteF-1s4vA:
19.16
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.
1scj SUBTILISIN E

(Bacillus
subtilis) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		3 TYR B 377
TYR A 104
GLY A 166
 None
 0.55A 3eteB-1scjB:
undetectable
3eteD-1scjB:
undetectable
3eteF-1scjB:
undetectable		 3eteB-1scjB:
9.17
3eteD-1scjB:
9.17
3eteF-1scjB:
9.17
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.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		3 TYR E 652
TYR E 425
GLY E 393
 None
FE  E 703 ( 4.1A)
None
 0.72A 3eteB-1suvE:
undetectable
3eteD-1suvE:
undetectable
3eteF-1suvE:
undetectable		 3eteB-1suvE:
22.16
3eteD-1suvE:
22.16
3eteF-1suvE:
22.16
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.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		3 TYR E 652
TYR E 425
GLY E 394
 None
FE  E 703 ( 4.1A)
None
 0.67A 3eteB-1suvE:
undetectable
3eteD-1suvE:
undetectable
3eteF-1suvE:
undetectable		 3eteB-1suvE:
22.16
3eteD-1suvE:
22.16
3eteF-1suvE:
22.16
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.
1t1e KUMAMOLISIN

(Bacillus sp.
MN-32) 		PF00082
(Peptidase_S8)
PF09286
(Pro-kuma_activ) 		3 TYR A 204
TYR A 452
GLY A 444
 None
 0.70A 3eteB-1t1eA:
undetectable
3eteD-1t1eA:
1.7
3eteF-1t1eA:
undetectable		 3eteB-1t1eA:
21.86
3eteD-1t1eA:
21.86
3eteF-1t1eA:
21.86
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.
1vlp NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Saccharomyces
cerevisiae) 		PF04095
(NAPRTase) 		3 TYR A 311
TYR A 303
GLY A 292
 None
 0.73A 3eteB-1vlpA:
undetectable
3eteD-1vlpA:
undetectable
3eteF-1vlpA:
undetectable		 3eteB-1vlpA:
23.19
3eteD-1vlpA:
23.19
3eteF-1vlpA:
23.19
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima) 		PF00258
(Flavodoxin_1) 		3 TYR A 190
TYR A 243
GLY A 172
 None
 0.62A 3eteB-1vmeA:
4.1
3eteD-1vmeA:
2.5
3eteF-1vmeA:
2.5		 3eteB-1vmeA:
22.11
3eteD-1vmeA:
22.11
3eteF-1vmeA:
22.11
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima) 		PF00258
(Flavodoxin_1) 		3 TYR A 243
TYR A 190
GLY A 170
 None
 0.55A 3eteB-1vmeA:
4.1
3eteD-1vmeA:
2.5
3eteF-1vmeA:
2.5		 3eteB-1vmeA:
22.11
3eteD-1vmeA:
22.11
3eteF-1vmeA:
22.11
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.
2cc3 PROTEIN VIRB8

(Agrobacterium
tumefaciens) 		PF04335
(VirB8) 		3 TYR A 112
TYR A 142
GLY A 153
 None
 0.55A 3eteB-2cc3A:
undetectable
3eteD-2cc3A:
undetectable
3eteF-2cc3A:
undetectable		 3eteB-2cc3A:
15.37
3eteD-2cc3A:
15.37
3eteF-2cc3A:
15.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3i OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		3 TYR A 324
TYR A  92
GLY A  62
 None
AL  A 687 ( 4.1A)
None
 0.73A 3eteB-2d3iA:
undetectable
3eteD-2d3iA:
undetectable
3eteF-2d3iA:
undetectable		 3eteB-2d3iA:
20.79
3eteD-2d3iA:
20.79
3eteF-2d3iA:
20.79
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.
2eiz ANTI-LYSOZYME
ANTIBODY FV REGION

(Homo sapiens) 		PF07686
(V-set) 		3 TYR A  36
TYR B  47
GLY B 100
 None
 0.76A 3eteB-2eizA:
undetectable
3eteD-2eizA:
undetectable
3eteF-2eizA:
undetectable		 3eteB-2eizA:
10.32
3eteD-2eizA:
10.32
3eteF-2eizA:
10.32
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.
2fvm DIHYDROPYRIMIDINASE

(Lachancea
kluyveri) 		PF01979
(Amidohydro_1) 		3 TYR A 503
TYR A 454
GLY A 506
 None
 0.67A 3eteB-2fvmA:
undetectable
3eteD-2fvmA:
undetectable
3eteF-2fvmA:
undetectable		 3eteB-2fvmA:
21.33
3eteD-2fvmA:
21.33
3eteF-2fvmA:
21.33
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.
2liv LEUCINE

(Escherichia
coli) 		PF13458
(Peripla_BP_6) 		3 TYR A 198
TYR A 150
GLY A 224
 None
 0.72A 3eteB-2livA:
6.4
3eteD-2livA:
3.9
3eteF-2livA:
6.3		 3eteB-2livA:
20.80
3eteD-2livA:
20.80
3eteF-2livA:
20.80
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.
2nrh TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE,
BAF FAMILY

(Campylobacter
jejuni) 		PF03309
(Pan_kinase) 		3 TYR A 188
TYR A  19
GLY A 173
 None
 0.75A 3eteB-2nrhA:
undetectable
3eteD-2nrhA:
undetectable
3eteF-2nrhA:
undetectable		 3eteB-2nrhA:
17.91
3eteD-2nrhA:
17.91
3eteF-2nrhA:
17.91
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.
2vjt ALLOPHYCOCYANIN
ALPHA SUBUNIT

(Gloeobacter
violaceus) 		PF00502
(Phycobilisome) 		3 TYR A  88
TYR A 155
GLY A 108
 CYC  A1081 (-4.1A)
None
CYC  A1081 ( 4.0A)
 0.73A 3eteB-2vjtA:
undetectable
3eteD-2vjtA:
undetectable
3eteF-2vjtA:
undetectable		 3eteB-2vjtA:
14.62
3eteD-2vjtA:
14.62
3eteF-2vjtA:
14.62
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.
2wqs AGGLUTININ RECEPTOR

(Streptococcus
gordonii) 		PF16364
(Antigen_C) 		3 TYR A1303
TYR A1395
GLY A1290
 None
 0.74A 3eteB-2wqsA:
undetectable
3eteD-2wqsA:
undetectable
3eteF-2wqsA:
undetectable		 3eteB-2wqsA:
22.05
3eteD-2wqsA:
22.05
3eteF-2wqsA:
22.05
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.
2wvi MITOTIC CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1
BETA

(Homo sapiens) 		PF08311
(Mad3_BUB1_I) 		3 TYR A 116
TYR A 141
GLY A 111
 None
 0.65A 3eteB-2wviA:
undetectable
3eteD-2wviA:
undetectable
3eteF-2wviA:
undetectable		 3eteB-2wviA:
15.86
3eteD-2wviA:
15.86
3eteF-2wviA:
15.86
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.
2wzr POLYPROTEIN

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 TYR 3 125
TYR 2 100
GLY 3 183
 None
 0.72A 3eteB-2wzr3:
undetectable
3eteD-2wzr3:
undetectable
3eteF-2wzr3:
undetectable		 3eteB-2wzr3:
20.65
3eteD-2wzr3:
20.65
3eteF-2wzr3:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y2w ARABINOFURANOSIDASE

(Bifidobacterium
longum) 		PF06964
(Alpha-L-AF_C) 		3 TYR A 110
TYR A  76
GLY A 148
 None
 0.65A 3eteB-2y2wA:
undetectable
3eteD-2y2wA:
undetectable
3eteF-2y2wA:
undetectable		 3eteB-2y2wA:
23.04
3eteD-2y2wA:
23.04
3eteF-2y2wA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yzm D-ALANINE--D-ALANINE
LIGASE

(Thermus
thermophilus) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 TYR A 258
TYR A 295
GLY A 204
 None
 0.67A 3eteB-2yzmA:
2.5
3eteD-2yzmA:
3.1
3eteF-2yzmA:
2.5		 3eteB-2yzmA:
21.00
3eteD-2yzmA:
21.00
3eteF-2yzmA:
21.00
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.
2znw SCFV10

(Mus musculus;
synthetic
construct) 		PF07686
(V-set) 		3 TYR A  36
TYR A 169
GLY A 222
 None
None
1PG  A 243 ( 4.7A)
 0.71A 3eteB-2znwA:
undetectable
3eteD-2znwA:
undetectable
3eteF-2znwA:
undetectable		 3eteB-2znwA:
18.74
3eteD-2znwA:
18.74
3eteF-2znwA:
18.74
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.
3aja PUTATIVE
UNCHARACTERIZED
PROTEIN

(Mycolicibacterium
smegmatis) 		PF01083
(Cutinase) 		3 TYR A 127
TYR A 143
GLY A 178
 None
 0.75A 3eteB-3ajaA:
undetectable
3eteD-3ajaA:
2.8
3eteF-3ajaA:
undetectable		 3eteB-3ajaA:
20.87
3eteD-3ajaA:
20.87
3eteF-3ajaA:
20.87
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.
3d62 3C-LIKE PROTEINASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF05409
(Peptidase_C30) 		3 TYR A 126
TYR A 161
GLY A 138
 None
 0.48A 3eteB-3d62A:
undetectable
3eteD-3d62A:
undetectable
3eteF-3d62A:
undetectable		 3eteB-3d62A:
19.21
3eteD-3d62A:
19.21
3eteF-3d62A:
19.21
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.
3e5b ISOCITRATE LYASE

(Brucella
abortus) 		PF00463
(ICL) 		3 TYR A 105
TYR A 165
GLY A  85
 None
 0.61A 3eteB-3e5bA:
undetectable
3eteD-3e5bA:
undetectable
3eteF-3e5bA:
undetectable		 3eteB-3e5bA:
23.14
3eteD-3e5bA:
23.14
3eteF-3e5bA:
23.14
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.
3gbw E3 UBIQUITIN-PROTEIN
LIGASE MYCBP2

(Mus musculus) 		PF08005
(PHR) 		3 TYR A1307
TYR A1246
GLY A1271
 None
 0.72A 3eteB-3gbwA:
undetectable
3eteD-3gbwA:
undetectable
3eteF-3gbwA:
undetectable		 3eteB-3gbwA:
16.97
3eteD-3gbwA:
16.97
3eteF-3gbwA:
16.97
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.
3h14 AMINOTRANSFERASE,
CLASSES I AND II

(Ruegeria
pomeroyi) 		PF00155
(Aminotran_1_2) 		3 TYR A 315
TYR A 125
GLY A  39
 None
 0.75A 3eteB-3h14A:
2.3
3eteD-3h14A:
2.4
3eteF-3h14A:
2.2		 3eteB-3h14A:
24.24
3eteD-3h14A:
24.24
3eteF-3h14A:
24.24
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.
3i12 D-ALANINE-D-ALANINE
LIGASE A

(Salmonella
enterica) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 TYR A 290
TYR A 328
GLY A 235
 None
 0.75A 3eteB-3i12A:
2.8
3eteD-3i12A:
3.7
3eteF-3i12A:
2.5		 3eteB-3i12A:
23.27
3eteD-3i12A:
23.27
3eteF-3i12A:
23.27
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.
3ifq E-CADHERIN
PLAKOGLOBIN

(Homo sapiens;
Mus musculus) 		PF00514
(Arm)
PF01049
(Cadherin_C) 		3 TYR A 297
TYR C 681
GLY C 685
 SEP  C 684 ( 4.8A)
None
SEP  C 686 ( 2.4A)
 0.64A 3eteB-3ifqA:
undetectable
3eteD-3ifqA:
undetectable
3eteF-3ifqA:
undetectable		 3eteB-3ifqA:
23.56
3eteD-3ifqA:
23.56
3eteF-3ifqA:
23.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jd5 28S RIBOSOMAL
PROTEIN S22,
MITOCHONDRIAL

(Bos taurus) 		no annotation 3 TYR a 249
TYR a 241
GLY a 269
 None
 0.53A 3eteB-3jd5a:
undetectable
3eteD-3jd5a:
undetectable
3eteF-3jd5a:
undetectable		 3eteB-3jd5a:
23.46
3eteD-3jd5a:
23.46
3eteF-3jd5a:
23.46
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.
3jtx AMINOTRANSFERASE

(Neisseria
meningitidis) 		PF00155
(Aminotran_1_2) 		3 TYR A 327
TYR A 129
GLY A  37
 None
LLP  A 244 (-3.5A)
MES  A 400 (-3.9A)
 0.69A 3eteB-3jtxA:
2.3
3eteD-3jtxA:
2.2
3eteF-3jtxA:
2.3		 3eteB-3jtxA:
22.46
3eteD-3jtxA:
22.46
3eteF-3jtxA:
22.46
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.
3m1m ORF904

(Sulfolobus
islandicus) 		PF09250
(Prim-Pol)
PF13010
(pRN1_helical) 		3 TYR A 302
TYR A 352
GLY A 312
 None
 0.71A 3eteB-3m1mA:
undetectable
3eteD-3m1mA:
undetectable
3eteF-3m1mA:
undetectable		 3eteB-3m1mA:
22.75
3eteD-3m1mA:
22.75
3eteF-3m1mA:
22.75
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.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		3 TYR A 657
TYR A 427
GLY A 387
 None
 0.71A 3eteB-3mc2A:
undetectable
3eteD-3mc2A:
undetectable
3eteF-3mc2A:
undetectable		 3eteB-3mc2A:
23.31
3eteD-3mc2A:
23.31
3eteF-3mc2A:
23.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n92 ALPHA-AMYLASE, GH57
FAMILY

(Thermococcus
kodakarensis) 		PF03065
(Glyco_hydro_57)
PF09210
(DUF1957) 		3 TYR A 353
TYR A 276
GLY A 266
 None
 0.73A 3eteB-3n92A:
undetectable
3eteD-3n92A:
undetectable
3eteF-3n92A:
undetectable		 3eteB-3n92A:
22.42
3eteD-3n92A:
22.42
3eteF-3n92A:
22.42
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.
3nb6 PENICILLIN-BINDING
PROTEIN 1A

(Aquifex
aeolicus) 		PF00912
(Transgly) 		3 TYR A 180
TYR A 210
GLY A 167
 None
 0.72A 3eteB-3nb6A:
undetectable
3eteD-3nb6A:
undetectable
3eteF-3nb6A:
undetectable		 3eteB-3nb6A:
17.56
3eteD-3nb6A:
17.56
3eteF-3nb6A:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3opu SPAP

(Streptococcus
mutans) 		PF16364
(Antigen_C) 		3 TYR A1379
TYR A1471
GLY A1366
 None
 0.71A 3eteB-3opuA:
undetectable
3eteD-3opuA:
undetectable
3eteF-3opuA:
undetectable		 3eteB-3opuA:
23.67
3eteD-3opuA:
23.67
3eteF-3opuA:
23.67
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.
3whi SUBTILISIN E

(Bacillus
subtilis) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		3 TYR A  77
TYR A 194
GLY A 256
 None
 0.63A 3eteB-3whiA:
2.1
3eteD-3whiA:
2.2
3eteF-3whiA:
2.0		 3eteB-3whiA:
20.71
3eteD-3whiA:
20.71
3eteF-3whiA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zys DYNAMIN-1

(Homo sapiens) 		PF00169
(PH) 		3 TYR C  92
TYR C  33
GLY C  24
 None
 0.75A 3eteB-3zysC:
undetectable
3eteD-3zysC:
undetectable
3eteF-3zysC:
undetectable		 3eteB-3zysC:
12.86
3eteD-3zysC:
12.86
3eteF-3zysC:
12.86
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.
4a9w MONOOXYGENASE

(Stenotrophomonas
maltophilia) 		PF13738
(Pyr_redox_3) 		3 TYR A  89
TYR A  81
GLY A  62
 None
 0.73A 3eteB-4a9wA:
2.3
3eteD-4a9wA:
2.8
3eteF-4a9wA:
2.8		 3eteB-4a9wA:
22.94
3eteD-4a9wA:
22.94
3eteF-4a9wA:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		3 TYR A 665
TYR A 433
GLY A 396
 CEL  A 711 (-4.5A)
FE  A 701 ( 4.2A)
None
 0.74A 3eteB-4fimA:
undetectable
3eteD-4fimA:
undetectable
3eteF-4fimA:
undetectable		 3eteB-4fimA:
21.26
3eteD-4fimA:
21.26
3eteF-4fimA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		3 TYR A 665
TYR A 433
GLY A 397
 CEL  A 711 (-4.5A)
FE  A 701 ( 4.2A)
None
 0.75A 3eteB-4fimA:
undetectable
3eteD-4fimA:
undetectable
3eteF-4fimA:
undetectable		 3eteB-4fimA:
21.26
3eteD-4fimA:
21.26
3eteF-4fimA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fu0 D-ALANINE--D-ALANINE
LIGASE 7

(Enterococcus
faecalis) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 TYR A 287
TYR A 325
GLY A 233
 None
 0.71A 3eteB-4fu0A:
3.2
3eteD-4fu0A:
3.2
3eteF-4fu0A:
3.1		 3eteB-4fu0A:
22.24
3eteD-4fu0A:
22.24
3eteF-4fu0A:
22.24
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.
4gh4 CAPSID PROTEIN VP2
CAPSID PROTEIN VP3

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 TYR C 125
TYR B 100
GLY C 183
 None
 0.73A 3eteB-4gh4C:
undetectable
3eteD-4gh4C:
undetectable
3eteF-4gh4C:
undetectable		 3eteB-4gh4C:
17.72
3eteD-4gh4C:
17.72
3eteF-4gh4C:
17.72
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.
4gzi GLUCAN
ENDO-1,3-BETA-D-GLUC
OSIDASE

(Solanum
tuberosum) 		PF00332
(Glyco_hydro_17) 		3 TYR A 178
TYR A 159
GLY A 122
 None
 0.62A 3eteB-4gziA:
undetectable
3eteD-4gziA:
undetectable
3eteF-4gziA:
undetectable		 3eteB-4gziA:
23.57
3eteD-4gziA:
23.57
3eteF-4gziA:
23.57
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 11
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 14

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00420
(Oxidored_q2)
PF00662
(Proton_antipo_N) 		3 TYR N 260
TYR L 589
GLY K  95
 None
 0.75A 3eteB-4heaN:
undetectable
3eteD-4heaN:
undetectable
3eteF-4heaN:
undetectable		 3eteB-4heaN:
19.14
3eteD-4heaN:
19.14
3eteF-4heaN:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jxr ACETYLTRANSFERASE

(Sinorhizobium
meliloti) 		PF13420
(Acetyltransf_4) 		3 TYR A 178
TYR A 183
GLY A  52
 2PE  A 202 (-3.4A)
None
2PE  A 202 (-3.6A)
 0.66A 3eteB-4jxrA:
undetectable
3eteD-4jxrA:
undetectable
3eteF-4jxrA:
undetectable		 3eteB-4jxrA:
16.84
3eteD-4jxrA:
16.84
3eteF-4jxrA:
16.84
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.
4kca ENDO-1,5-ALPHA-L-ARA
BINANASE

(Bos taurus) 		PF00085
(Thioredoxin)
PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		3 TYR A 233
TYR A 313
GLY A 340
 None
 0.72A 3eteB-4kcaA:
undetectable
3eteD-4kcaA:
undetectable
3eteF-4kcaA:
undetectable		 3eteB-4kcaA:
21.84
3eteD-4kcaA:
21.84
3eteF-4kcaA:
21.84
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.
4kqc PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Brachyspira
murdochii) 		PF13407
(Peripla_BP_4) 		3 TYR A 339
TYR A 324
GLY A 274
 None
 0.74A 3eteB-4kqcA:
1.9
3eteD-4kqcA:
5.0
3eteF-4kqcA:
2.2		 3eteB-4kqcA:
20.65
3eteD-4kqcA:
20.65
3eteF-4kqcA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN

(Rhodopirellula
baltica) 		PF13458
(Peripla_BP_6) 		3 TYR A 229
TYR A 101
GLY A 257
 None
FMT  A 501 (-4.6A)
None
 0.69A 3eteB-4kv7A:
4.6
3eteD-4kv7A:
5.0
3eteF-4kv7A:
4.6		 3eteB-4kv7A:
24.95
3eteD-4kv7A:
24.95
3eteF-4kv7A:
24.95
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.
4l1k D-ALANINE--D-ALANINE
LIGASE

(Xanthomonas
oryzae) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 TYR A 290
TYR A 328
GLY A 235
 None
 0.74A 3eteB-4l1kA:
3.2
3eteD-4l1kA:
2.4
3eteF-4l1kA:
2.8		 3eteB-4l1kA:
19.54
3eteD-4l1kA:
19.54
3eteF-4l1kA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l95 GAMMA-GLUTAMYL
HYDROLASE

(Danio rerio) 		no annotation 3 TYR E  34
TYR E  29
GLY E  71
 None
 0.74A 3eteB-4l95E:
undetectable
3eteD-4l95E:
2.1
3eteF-4l95E:
2.1		 3eteB-4l95E:
22.22
3eteD-4l95E:
22.22
3eteF-4l95E:
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.
4lqz UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF16253
(DUF4909) 		3 TYR A  49
TYR A  67
GLY A   0
 None
 0.71A 3eteB-4lqzA:
undetectable
3eteD-4lqzA:
undetectable
3eteF-4lqzA:
undetectable		 3eteB-4lqzA:
16.98
3eteD-4lqzA:
16.98
3eteF-4lqzA:
16.98
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.
4n0q LEU/ILE/VAL-BINDING
PROTEIN HOMOLOG 3

(Brucella
melitensis) 		PF13458
(Peripla_BP_6) 		3 TYR A 220
TYR A 172
GLY A 246
 None
LEU  A 500 (-3.6A)
None
 0.70A 3eteB-4n0qA:
5.6
3eteD-4n0qA:
5.1
3eteF-4n0qA:
5.7		 3eteB-4n0qA:
22.54
3eteD-4n0qA:
22.54
3eteF-4n0qA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ony EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 5

(Brucella
melitensis) 		PF00496
(SBP_bac_5) 		3 TYR A 229
TYR A 256
GLY A  72
 None
 0.39A 3eteB-4onyA:
undetectable
3eteD-4onyA:
undetectable
3eteF-4onyA:
undetectable		 3eteB-4onyA:
20.39
3eteD-4onyA:
20.39
3eteF-4onyA:
20.39
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.
4ovx XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL

(Planctopirus
limnophila) 		PF01261
(AP_endonuc_2) 		3 TYR A 233
TYR A 164
GLY A 201
 None
 0.68A 3eteB-4ovxA:
undetectable
3eteD-4ovxA:
undetectable
3eteF-4ovxA:
undetectable		 3eteB-4ovxA:
20.12
3eteD-4ovxA:
20.12
3eteF-4ovxA:
20.12
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.
4p48 ANTIBODY SCFV 180

(Gallus gallus) 		PF07686
(V-set) 		3 TYR A  88
TYR A 223
GLY A 172
 None
 0.72A 3eteB-4p48A:
undetectable
3eteD-4p48A:
undetectable
3eteF-4p48A:
undetectable		 3eteB-4p48A:
20.28
3eteD-4p48A:
20.28
3eteF-4p48A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q5f GLUTATHIONE
S-TRANSFERASE 1

(Ascaris suum) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		3 TYR A   8
TYR A  68
GLY A  13
 None
 0.62A 3eteB-4q5fA:
undetectable
3eteD-4q5fA:
undetectable
3eteF-4q5fA:
undetectable		 3eteB-4q5fA:
18.88
3eteD-4q5fA:
18.88
3eteF-4q5fA:
18.88
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.
4qlz SJCHGC07024 PROTEIN

(Schistosoma
japonicum) 		PF00719
(Pyrophosphatase) 		3 TYR A  26
TYR A  13
GLY A 130
 None
 0.58A 3eteB-4qlzA:
undetectable
3eteD-4qlzA:
undetectable
3eteF-4qlzA:
undetectable		 3eteB-4qlzA:
20.98
3eteD-4qlzA:
20.98
3eteF-4qlzA:
20.98
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.
4tll RECEPTOR SUBUNIT
GLUN2B

(Xenopus laevis) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		3 TYR B 226
TYR B 351
GLY B 173
 None
 0.73A 3eteB-4tllB:
4.4
3eteD-4tllB:
4.4
3eteF-4tllB:
4.4		 3eteB-4tllB:
21.15
3eteD-4tllB:
21.15
3eteF-4tllB:
21.15
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.
4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Cellvibrio sp.
BR) 		PF13738
(Pyr_redox_3) 		3 TYR A  99
TYR A  91
GLY A  72
 None
 0.74A 3eteB-4usqA:
undetectable
3eteD-4usqA:
2.3
3eteF-4usqA:
2.4		 3eteB-4usqA:
22.40
3eteD-4usqA:
22.40
3eteF-4usqA:
22.40
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.
4zro 3C-LIKE PROTEINASE

(Alphacoronavirus
1) 		PF05409
(Peptidase_C30) 		3 TYR A 125
TYR A 160
GLY A 137
 None
 0.63A 3eteB-4zroA:
undetectable
3eteD-4zroA:
undetectable
3eteF-4zroA:
undetectable		 3eteB-4zroA:
21.76
3eteD-4zroA:
21.76
3eteF-4zroA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aca VP2
VP3

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 TYR 3 124
TYR 2 100
GLY 3 184
 None
 0.55A 3eteB-5aca3:
undetectable
3eteD-5aca3:
undetectable
3eteF-5aca3:
undetectable		 3eteB-5aca3:
17.80
3eteD-5aca3:
17.80
3eteF-5aca3:
17.80
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.
5dly PLANTAZOLICIN
METHYLTRANSFERASE
BAML

(Bacillus
velezensis) 		PF13847
(Methyltransf_31) 		3 TYR A 187
TYR A  33
GLY A 170
 None
5D7  A 300 (-4.8A)
None
 0.52A 3eteB-5dlyA:
4.0
3eteD-5dlyA:
3.8
3eteF-5dlyA:
2.2		 3eteB-5dlyA:
19.52
3eteD-5dlyA:
19.52
3eteF-5dlyA:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hy3 MRNA
ENDORIBONUCLEASE
LSOA

(Escherichia
coli) 		PF15935
(RnlA_toxin) 		3 TYR A 298
TYR A 250
GLY A 266
 None
 0.73A 3eteB-5hy3A:
undetectable
3eteD-5hy3A:
undetectable
3eteF-5hy3A:
undetectable		 3eteB-5hy3A:
21.85
3eteD-5hy3A:
21.85
3eteF-5hy3A:
21.85
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.
5hyo PEDV 3CLPRO

(Porcine
epidemic
diarrhea virus) 		PF05409
(Peptidase_C30) 		3 TYR A 125
TYR A 160
GLY A 137
 None
 0.41A 3eteB-5hyoA:
undetectable
3eteD-5hyoA:
undetectable
3eteF-5hyoA:
undetectable		 3eteB-5hyoA:
23.89
3eteD-5hyoA:
23.89
3eteF-5hyoA:
23.89
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.
5id6 CPF1

(Lachnospiraceae
bacterium
ND2006) 		no annotation 3 TYR A1185
TYR A1221
GLY A 848
 None
 0.74A 3eteB-5id6A:
undetectable
3eteD-5id6A:
undetectable
3eteF-5id6A:
undetectable		 3eteB-5id6A:
18.52
3eteD-5id6A:
18.52
3eteF-5id6A:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 3 TYR A 207
TYR A 175
GLY A 225
 None
 0.68A 3eteB-5jvkA:
undetectable
3eteD-5jvkA:
1.7
3eteF-5jvkA:
undetectable		 3eteB-5jvkA:
22.08
3eteD-5jvkA:
22.08
3eteF-5jvkA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kym 1-ACYL-SN-GLYCEROL-3
-PHOSPHATE
ACYLTRANSFERASE

(Thermotoga
maritima) 		PF01553
(Acyltransferase) 		3 TYR A 117
TYR A  44
GLY A  25
 DD9  A 304 (-3.4A)
None
DD9  A 304 ( 3.9A)
 0.75A 3eteB-5kymA:
undetectable
3eteD-5kymA:
undetectable
3eteF-5kymA:
undetectable		 3eteB-5kymA:
20.16
3eteD-5kymA:
20.16
3eteF-5kymA:
20.16
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.
5lcw MITOTIC CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1
BETA,MITOTIC
CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1
BETA

(Homo sapiens) 		PF08311
(Mad3_BUB1_I) 		3 TYR S 116
TYR S 141
GLY S 111
 None
 0.59A 3eteB-5lcwS:
undetectable
3eteD-5lcwS:
undetectable
3eteF-5lcwS:
undetectable		 3eteB-5lcwS:
20.16
3eteD-5lcwS:
20.16
3eteF-5lcwS:
20.16
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.
5mjv CAPSID SUBUNIT VP0
CAPSID SUBUNIT VP1

(Parechovirus A) 		PF00073
(Rhv)
no annotation 		3 TYR C 187
TYR A 109
GLY C 241
 None
 0.69A 3eteB-5mjvC:
undetectable
3eteD-5mjvC:
undetectable
3eteF-5mjvC:
undetectable		 3eteB-5mjvC:
19.43
3eteD-5mjvC:
19.43
3eteF-5mjvC:
19.43
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.
5ng7 EPOXIDE HYDROLASE

(metagenome) 		no annotation 3 TYR A  62
TYR A 209
GLY A  33
 None
 0.75A 3eteB-5ng7A:
undetectable
3eteD-5ng7A:
undetectable
3eteF-5ng7A:
undetectable		 3eteB-5ng7A:
10.28
3eteD-5ng7A:
10.28
3eteF-5ng7A:
10.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o82 INTRACELLULAR
EXO-ALPHA-(1->5)-L-A
RABINOFURANOSIDASE

(Chaetomium
thermophilum) 		no annotation 3 TYR A  68
TYR A  34
GLY A 106
 None
 0.76A 3eteB-5o82A:
undetectable
3eteD-5o82A:
undetectable
3eteF-5o82A:
undetectable		 3eteB-5o82A:
13.08
3eteD-5o82A:
13.08
3eteF-5o82A:
13.08
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.
5xj3 IPILIMUMAB-VH
IPILIMUMAB-VL

(Homo sapiens) 		no annotation 3 TYR B  88
TYR A  95
GLY A  44
 None
 0.75A 3eteB-5xj3B:
undetectable
3eteD-5xj3B:
undetectable
3eteF-5xj3B:
undetectable		 3eteB-5xj3B:
9.92
3eteD-5xj3B:
9.92
3eteF-5xj3B:
9.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum) 		no annotation 3 TYR A 660
TYR A 799
GLY A  80
 None
 0.49A 3eteB-5xqoA:
undetectable
3eteD-5xqoA:
undetectable
3eteF-5xqoA:
undetectable		 3eteB-5xqoA:
10.31
3eteD-5xqoA:
10.31
3eteF-5xqoA:
10.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bdz DISINTEGRIN AND
METALLOPROTEINASE
DOMAIN-CONTAINING
PROTEIN 10

(Homo sapiens) 		no annotation 3 TYR A 257
TYR A 316
GLY A 386
 None
 0.68A 3eteB-6bdzA:
undetectable
3eteD-6bdzA:
undetectable
3eteF-6bdzA:
undetectable		 3eteB-6bdzA:
10.00
3eteD-6bdzA:
10.00
3eteF-6bdzA:
10.00
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.
6f5d ATP SYNTHASE EPSILON
SUBUNIT
ATP SYNTHASE GAMMA
SUBUNIT

(Trypanosoma
brucei) 		no annotation 3 TYR I  42
TYR I  66
GLY G 137
 None
 0.72A 3eteB-6f5dI:
undetectable
3eteD-6f5dI:
undetectable
3eteF-6f5dI:
undetectable		 3eteB-6f5dI:
10.28
3eteD-6f5dI:
10.28
3eteF-6f5dI:
10.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f74 ALCOHOL OXIDASE

(Thermothelomyces
thermophila) 		no annotation 3 TYR A 352
TYR A 540
GLY A 247
 None
FAD  A 601 (-4.9A)
None
 0.76A 3eteB-6f74A:
undetectable
3eteD-6f74A:
undetectable
3eteF-6f74A:
undetectable		 3eteB-6f74A:
11.68
3eteD-6f74A:
11.68
3eteF-6f74A:
11.68