SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'BIO'


List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 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.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 1os2A-1y13A:
undetectable		 1os2A-1y13A:
16.22
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.
1OS2_A_HAEA874_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.95A 1os2A-2a0sA:
undetectable		 1os2A-2a0sA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OS2_D_HAED574_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.93A 1os2D-1y13A:
undetectable		 1os2D-1y13A:
16.22
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.
1OS2_D_HAED574_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.92A 1os2D-2a0sA:
undetectable		 1os2D-2a0sA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1R55_A_097A518_1
(ADAM 33)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		5 / 10 THR A  46
HIS A  48
GLU A  45
HIS A  36
HIS A  50
 None
ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 1.25A 1r55A-2a0sA:
undetectable		 1r55A-2a0sA:
19.91
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.
1UTT_A_HAEA1265_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 1uttA-1y13A:
undetectable		 1uttA-1y13A:
18.38
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.
1UTT_A_HAEA1265_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.94A 1uttA-2a0sA:
undetectable		 1uttA-2a0sA:
21.54
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.
1UTZ_A_HAEA1267_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 1utzA-1y13A:
undetectable		 1utzA-1y13A:
18.38
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.
1UTZ_A_HAEA1267_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.94A 1utzA-2a0sA:
undetectable		 1utzA-2a0sA:
21.54
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.
1UTZ_B_HAEB1266_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.93A 1utzB-1y13A:
undetectable		 1utzB-1y13A:
18.38
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.
1UTZ_B_HAEB1266_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.92A 1utzB-2a0sA:
undetectable		 1utzB-2a0sA:
21.54
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.
1Y93_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 6 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.92A 1y93A-1y13A:
undetectable		 1y93A-1y13A:
18.38
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.
1Y93_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 6 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.91A 1y93A-2a0sA:
undetectable		 1y93A-2a0sA:
21.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_A_H4BA1003_1
(HYPOTHETICAL PROTEIN
PH0634)		 1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Rattus
rattus) 		7 / 10 HIS A  23
HIS A  48
HIS A  50
THR A 105
THR A 106
GLU A 107
GLU A 133
 ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
BIO  A 700 (-4.3A)
BIO  A 700 (-3.7A)
BIO  A 700 (-3.0A)
BIO  A 700 ( 2.7A)
 0.62A 2dttA-1b66A:
16.1
2dttC-1b66A:
16.0		 2dttA-1b66A:
31.43
2dttC-1b66A:
31.43
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.
2DTT_A_H4BA1003_1
(HYPOTHETICAL PROTEIN
PH0634)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		6 / 10 HIS A  29
HIS A  41
HIS A  43
THR A 127
GLU A 128
GLU A 161
 ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.3A)
ZN  A 174 ( 3.4A)
BIO  A 175 ( 4.7A)
BIO  A 175 (-2.8A)
BIO  A 175 (-3.1A)
 0.86A 2dttA-1y13A:
13.0
2dttC-1y13A:
12.7		 2dttA-1y13A:
22.65
2dttC-1y13A:
22.65
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.
2DTT_A_H4BA1003_1
(HYPOTHETICAL PROTEIN
PH0634)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		6 / 10 HIS A  36
HIS A  48
HIS A  50
THR A 134
GLU A 135
GLU A 168
 ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
ZN  A 281 (-3.3A)
BIO  A 282 (-3.8A)
BIO  A 282 (-3.0A)
BIO  A 282 ( 2.8A)
 0.65A 2dttA-2a0sA:
12.3
2dttC-2a0sA:
12.1		 2dttA-2a0sA:
23.33
2dttC-2a0sA:
23.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_A_H4BA1003_1
(HYPOTHETICAL PROTEIN
PH0634)		 3qna 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE
(Escherichia
coli) 		6 / 10 HIS A  15
HIS A  30
HIS A  32
THR A  83
GLU A  85
GLU A 109
 ZN  A 122 ( 3.3A)
ZN  A 122 ( 3.2A)
ZN  A 122 ( 3.2A)
BIO  A 121 (-4.2A)
BIO  A 121 (-2.9A)
BIO  A 121 (-2.8A)
 0.59A 2dttA-3qnaA:
15.8
2dttC-3qnaA:
15.7		 2dttA-3qnaA:
32.41
2dttC-3qnaA:
32.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_B_H4BB1001_1
(HYPOTHETICAL PROTEIN
PH0634)		 1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Rattus
rattus) 		5 / 10 HIS A  48
THR A 105
THR A 106
GLU A 107
GLU A 133
 ZN  A 401 ( 3.4A)
BIO  A 700 (-4.3A)
BIO  A 700 (-3.7A)
BIO  A 700 (-3.0A)
BIO  A 700 ( 2.7A)
 0.70A 2dttA-1b66A:
16.1
2dttB-1b66A:
15.5		 2dttA-1b66A:
31.43
2dttB-1b66A:
31.43
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.
2DTT_B_H4BB1001_1
(HYPOTHETICAL PROTEIN
PH0634)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		5 / 10 GLU A  38
HIS A  41
THR A 127
GLU A 128
GLU A 161
 BIO  A 175 (-2.6A)
ZN  A 174 ( 3.3A)
BIO  A 175 ( 4.7A)
BIO  A 175 (-2.8A)
BIO  A 175 (-3.1A)
 0.84A 2dttA-1y13A:
13.0
2dttB-1y13A:
14.0		 2dttA-1y13A:
22.65
2dttB-1y13A:
22.65
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.
2DTT_B_H4BB1001_1
(HYPOTHETICAL PROTEIN
PH0634)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		5 / 10 GLU A  45
HIS A  48
THR A 134
GLU A 135
GLU A 168
 BIO  A 282 (-3.1A)
ZN  A 281 (-3.3A)
BIO  A 282 (-3.8A)
BIO  A 282 (-3.0A)
BIO  A 282 ( 2.8A)
 0.75A 2dttA-2a0sA:
12.3
2dttB-2a0sA:
13.4		 2dttA-2a0sA:
23.33
2dttB-2a0sA:
23.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Rattus
rattus) 		7 / 10 HIS A  23
HIS A  48
HIS A  50
THR A 105
THR A 106
GLU A 107
GLU A 133
 ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
BIO  A 700 (-4.3A)
BIO  A 700 (-3.7A)
BIO  A 700 (-3.0A)
BIO  A 700 ( 2.7A)
 0.71A 2dttD-1b66A:
16.2
2dttF-1b66A:
16.0		 2dttD-1b66A:
31.43
2dttF-1b66A:
31.43
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.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		6 / 10 HIS A  29
HIS A  41
HIS A  43
THR A 127
GLU A 128
GLU A 161
 ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.3A)
ZN  A 174 ( 3.4A)
BIO  A 175 ( 4.7A)
BIO  A 175 (-2.8A)
BIO  A 175 (-3.1A)
 0.71A 2dttD-1y13A:
12.7
2dttF-1y13A:
12.6		 2dttD-1y13A:
22.65
2dttF-1y13A:
22.65
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.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		6 / 10 HIS A  36
HIS A  48
HIS A  50
THR A 134
GLU A 135
GLU A 168
 ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
ZN  A 281 (-3.3A)
BIO  A 282 (-3.8A)
BIO  A 282 (-3.0A)
BIO  A 282 ( 2.8A)
 0.75A 2dttD-2a0sA:
12.3
2dttF-2a0sA:
12.3		 2dttD-2a0sA:
23.33
2dttF-2a0sA:
23.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 3qna 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE
(Escherichia
coli) 		6 / 10 HIS A  15
HIS A  30
HIS A  32
THR A  83
GLU A  85
GLU A 109
 ZN  A 122 ( 3.3A)
ZN  A 122 ( 3.2A)
ZN  A 122 ( 3.2A)
BIO  A 121 (-4.2A)
BIO  A 121 (-2.9A)
BIO  A 121 (-2.8A)
 0.74A 2dttD-3qnaA:
15.6
2dttF-3qnaA:
15.7		 2dttD-3qnaA:
32.41
2dttF-3qnaA:
32.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_E_H4BE1004_1
(HYPOTHETICAL PROTEIN
PH0634)		 1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Rattus
rattus) 		7 / 11 HIS A  23
HIS A  48
HIS A  50
THR A 105
THR A 106
GLU A 107
GLU A 133
 ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
ZN  A 401 ( 3.4A)
BIO  A 700 (-4.3A)
BIO  A 700 (-3.7A)
BIO  A 700 (-3.0A)
BIO  A 700 ( 2.7A)
 0.73A 2dttD-1b66A:
16.2
2dttE-1b66A:
15.5		 2dttD-1b66A:
31.43
2dttE-1b66A:
31.43
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.
2DTT_E_H4BE1004_1
(HYPOTHETICAL PROTEIN
PH0634)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		6 / 11 HIS A  29
HIS A  41
HIS A  43
THR A 127
GLU A 128
GLU A 161
 ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.3A)
ZN  A 174 ( 3.4A)
BIO  A 175 ( 4.7A)
BIO  A 175 (-2.8A)
BIO  A 175 (-3.1A)
 0.95A 2dttD-1y13A:
12.7
2dttE-1y13A:
14.0		 2dttD-1y13A:
22.65
2dttE-1y13A:
22.65
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.
2DTT_E_H4BE1004_1
(HYPOTHETICAL PROTEIN
PH0634)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		6 / 11 HIS A  36
HIS A  48
HIS A  50
THR A 134
GLU A 135
GLU A 168
 ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
ZN  A 281 (-3.3A)
BIO  A 282 (-3.8A)
BIO  A 282 (-3.0A)
BIO  A 282 ( 2.8A)
 0.66A 2dttD-2a0sA:
12.3
2dttE-2a0sA:
13.4		 2dttD-2a0sA:
23.33
2dttE-2a0sA:
23.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_E_H4BE1004_1
(HYPOTHETICAL PROTEIN
PH0634)		 3qna 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE
(Escherichia
coli) 		5 / 11 HIS A  15
HIS A  30
HIS A  32
GLU A  85
GLU A 109
 ZN  A 122 ( 3.3A)
ZN  A 122 ( 3.2A)
ZN  A 122 ( 3.2A)
BIO  A 121 (-2.9A)
BIO  A 121 (-2.8A)
 0.61A 2dttD-3qnaA:
15.6
2dttE-3qnaA:
16.8		 2dttD-3qnaA:
32.41
2dttE-3qnaA:
32.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_E_H4BE1004_1
(HYPOTHETICAL PROTEIN
PH0634)		 3qna 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE
(Escherichia
coli) 		5 / 11 HIS A  15
HIS A  30
THR A  83
GLU A  85
GLU A 109
 ZN  A 122 ( 3.3A)
ZN  A 122 ( 3.2A)
BIO  A 121 (-4.2A)
BIO  A 121 (-2.9A)
BIO  A 121 (-2.8A)
 0.55A 2dttD-3qnaA:
15.6
2dttE-3qnaA:
16.8		 2dttD-3qnaA:
32.41
2dttE-3qnaA:
32.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DTT_F_H4BF1005_1
(HYPOTHETICAL PROTEIN
PH0634)		 1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Rattus
rattus) 		5 / 9 HIS A  50
THR A 105
THR A 106
GLU A 107
GLU A 133
 ZN  A 401 ( 3.4A)
BIO  A 700 (-4.3A)
BIO  A 700 (-3.7A)
BIO  A 700 (-3.0A)
BIO  A 700 ( 2.7A)
 0.54A 2dttE-1b66A:
15.5
2dttF-1b66A:
16.0		 2dttE-1b66A:
31.43
2dttF-1b66A:
31.43
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.
2HU6_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.91A 2hu6A-1y13A:
undetectable		 2hu6A-1y13A:
18.38
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.
2HU6_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.90A 2hu6A-2a0sA:
undetectable		 2hu6A-2a0sA:
21.61
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.
2JIH_A_097A1001_1
(ADAMTS-1)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		5 / 9 THR A  39
HIS A  41
GLU A  38
HIS A  29
HIS A  43
 None
ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 1.23A 2jihA-1y13A:
undetectable		 2jihA-1y13A:
15.61
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.
2JIH_A_097A1001_1
(ADAMTS-1)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		5 / 9 THR A  46
HIS A  48
GLU A  45
HIS A  36
HIS A  50
 None
ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 1.21A 2jihA-2a0sA:
undetectable		 2jihA-2a0sA:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OW9_B_HAEB502_1
(COLLAGENASE 3)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.97A 2ow9B-1y13A:
undetectable		 2ow9B-1y13A:
18.97
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.
2OW9_B_HAEB502_1
(COLLAGENASE 3)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.95A 2ow9B-2a0sA:
undetectable		 2ow9B-2a0sA:
17.11
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.
2OZR_C_HAEC3001_1
(COLLAGENASE 3)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.97A 2ozrC-1y13A:
undetectable		 2ozrC-1y13A:
18.97
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.
2OZR_C_HAEC3001_1
(COLLAGENASE 3)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.95A 2ozrC-2a0sA:
undetectable		 2ozrC-2a0sA:
17.11
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.
2OZR_D_HAED3002_1
(COLLAGENASE 3)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.98A 2ozrD-1y13A:
undetectable		 2ozrD-1y13A:
18.97
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.
2OZR_D_HAED3002_1
(COLLAGENASE 3)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.96A 2ozrD-2a0sA:
undetectable		 2ozrD-2a0sA:
17.11
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.
2OZR_E_HAEE3003_1
(COLLAGENASE 3)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 2ozrE-1y13A:
undetectable		 2ozrE-1y13A:
18.97
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.
2OZR_E_HAEE3003_1
(COLLAGENASE 3)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.94A 2ozrE-2a0sA:
undetectable		 2ozrE-2a0sA:
17.11
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.
3HY7_A_097A801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		5 / 9 THR A  39
HIS A  41
GLU A  38
HIS A  29
HIS A  43
 None
ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 1.21A 3hy7A-1y13A:
undetectable		 3hy7A-1y13A:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HY7_A_097A801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		5 / 9 THR A  46
HIS A  48
GLU A  45
HIS A  36
HIS A  50
 None
ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 1.19A 3hy7A-2a0sA:
undetectable		 3hy7A-2a0sA:
22.49
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.
3HY7_B_097B801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		5 / 9 THR A  39
HIS A  41
GLU A  38
HIS A  29
HIS A  43
 None
ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 1.24A 3hy7B-1y13A:
undetectable		 3hy7B-1y13A:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HY7_B_097B801_1
(A DISINTEGRIN AND
METALLOPROTEINASE
WITH THROMBOSPONDIN
MOTIFS 5)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		5 / 9 THR A  46
HIS A  48
GLU A  45
HIS A  36
HIS A  50
 None
ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 1.21A 3hy7B-2a0sA:
undetectable		 3hy7B-2a0sA:
22.49
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.
3KEC_A_HAEA272_1
(COLLAGENASE 3)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 3kecA-1y13A:
undetectable		 3kecA-1y13A:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KEC_A_HAEA272_1
(COLLAGENASE 3)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.94A 3kecA-2a0sA:
undetectable		 3kecA-2a0sA:
16.58
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.
3LIK_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.96A 3likA-1y13A:
undetectable		 3likA-1y13A:
18.38
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.
3LIK_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.94A 3likA-2a0sA:
undetectable		 3likA-2a0sA:
21.61
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.
3LIL_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.94A 3lilA-1y13A:
undetectable		 3lilA-1y13A:
18.38
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.
3LIL_A_HAEA302_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.93A 3lilA-2a0sA:
undetectable		 3lilA-2a0sA:
21.61
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.
3LJG_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.90A 3ljgA-1y13A:
undetectable		 3ljgA-1y13A:
18.38
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.
3LJG_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.89A 3ljgA-2a0sA:
undetectable		 3ljgA-2a0sA:
21.61
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.
3LKA_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.94A 3lkaA-1y13A:
undetectable		 3lkaA-1y13A:
17.84
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.
3LKA_A_HAEA269_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.93A 3lkaA-2a0sA:
undetectable		 3lkaA-2a0sA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 7 THR A 127
HIS A  41
ILE A  31
HIS A  29
 BIO  A 175 ( 4.7A)
ZN  A 174 ( 3.3A)
BIO  A 175 (-4.2A)
ZN  A 174 ( 3.5A)
 1.08A 3t01A-1y13A:
undetectable		 3t01A-1y13A:
15.14
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.
4V1F_A_BQ1A1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		3 / 3 GLU A  38
ALA A  32
PHE A  36
 BIO  A 175 (-2.6A)
None
None
 0.65A 4v1fA-1y13A:
undetectable		 4v1fA-1y13A:
15.52
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.
4V1F_A_BQ1A1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		3 / 3 GLU A  45
ALA A  39
PHE A  43
 BIO  A 282 (-3.1A)
None
None
 0.57A 4v1fA-2a0sA:
undetectable		 4v1fA-2a0sA:
17.88
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.
4V1F_C_BQ1C1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		3 / 3 GLU A  38
ALA A  32
PHE A  36
 BIO  A 175 (-2.6A)
None
None
 0.67A 4v1fC-1y13A:
undetectable		 4v1fC-1y13A:
15.52
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.
4V1F_C_BQ1C1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		3 / 3 GLU A  45
ALA A  39
PHE A  43
 BIO  A 282 (-3.1A)
None
None
 0.58A 4v1fC-2a0sA:
undetectable		 4v1fC-2a0sA:
17.88
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.
5N5J_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 4 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.93A 5n5jA-1y13A:
undetectable		 5n5jA-1y13A:
17.84
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.
5N5J_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 4 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.92A 5n5jA-2a0sA:
undetectable		 5n5jA-2a0sA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N5K_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 1y13 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
falciparum) 		4 / 5 HIS A  41
GLU A  38
HIS A  29
HIS A  43
 ZN  A 174 ( 3.3A)
BIO  A 175 (-2.6A)
ZN  A 174 ( 3.5A)
ZN  A 174 ( 3.4A)
 0.92A 5n5kA-1y13A:
undetectable		 5n5kA-1y13A:
17.84
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.
5N5K_A_HAEA306_1
(MACROPHAGE
METALLOELASTASE)		 2a0s 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE
(Plasmodium
vivax) 		4 / 5 HIS A  48
GLU A  45
HIS A  36
HIS A  50
 ZN  A 281 (-3.3A)
BIO  A 282 (-3.1A)
ZN  A 281 ( 3.5A)
ZN  A 281 (-3.3A)
 0.91A 5n5kA-2a0sA:
undetectable		 5n5kA-2a0sA:
19.44