SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1u3i'

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.
11GS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 7 TYR A  10
PHE A  11
GLY A  15
ARG A  16
 None
None
None
GSH  A 301 (-4.2A)
 0.66A 11gsB-1u3iA:
23.6		 11gsB-1u3iA:
23.74
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.
1GTI_D_CCSD47_0
(GLUTATHIONE
S-TRANSFERASE)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 7 TRP A  41
THR A  47
GLY A  51
LEU A  53
 GSH  A 301 (-4.0A)
None
None
GSH  A 301 (-4.4A)
 0.56A 1gtiD-1u3iA:
22.8		 1gtiD-1u3iA:
28.00
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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		5 / 12 LEU A 143
VAL A 162
LEU A 161
LEU A  98
VAL A  95
 None
 1.22A 2c12C-1u3iA:
2.9		 2c12C-1u3iA:
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.
2GSS_A_EAAA0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 8 TYR A  10
PHE A  11
ARG A  16
TRP A  41
 None
None
GSH  A 301 (-4.2A)
GSH  A 301 (-4.0A)
 0.90A 2gssA-1u3iA:
23.6		 2gssA-1u3iA:
23.29
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.
2GSS_B_EAAB0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 8 TYR A  10
PHE A  11
ARG A  16
TRP A  41
 None
None
GSH  A 301 (-4.2A)
GSH  A 301 (-4.0A)
 0.90A 2gssB-1u3iA:
23.6		 2gssB-1u3iA:
23.29
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.
2I30_A_SALA1200_1
(SERUM ALBUMIN)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 4 LEU A 158
ILE A  20
ILE A  74
ALA A  73
 None
 0.87A 2i30A-1u3iA:
1.6		 2i30A-1u3iA:
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.
3AG1_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.22A 3ag1J-1u3iA:
0.0		 3ag1J-1u3iA:
16.23
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.
3CO4_A_GCSA401_1
(CHITINASE)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		3 / 3 GLU A   4
HIS A  64
HIS A  62
 None
 0.92A 3co4A-1u3iA:
undetectable		 3co4A-1u3iA:
22.76
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.
3FL9_G_TOPG200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		5 / 12 ALA A 102
LEU A 163
ILE A 185
LEU A 178
PHE A 136
 None
 0.98A 3fl9G-1u3iA:
undetectable		 3fl9G-1u3iA:
25.36
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.
3FW3_A_ETSA302_1
(CARBONIC ANHYDRASE 4)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		5 / 12 VAL A  56
ILE A   6
VAL A   8
LEU A  24
THR A  23
 None
 0.79A 3fw3A-1u3iA:
0.0		 3fw3A-1u3iA:
24.26
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.
3FW3_B_ETSB303_1
(CARBONIC ANHYDRASE 4)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		5 / 12 VAL A  56
ILE A   6
VAL A   8
LEU A  24
THR A  23
 None
 0.77A 3fw3B-1u3iA:
0.0		 3fw3B-1u3iA:
24.26
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.
3N9J_A_EAAA210_1
(GLUTATHIONE
S-TRANSFERASE P)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 8 TYR A  10
PHE A  11
ARG A  16
TRP A  41
 None
None
GSH  A 301 (-4.2A)
GSH  A 301 (-4.0A)
 0.92A 3n9jA-1u3iA:
23.5		 3n9jA-1u3iA:
23.74
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.
3N9J_B_EAAB214_1
(GLUTATHIONE
S-TRANSFERASE P)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 8 TYR A  10
PHE A  11
GLY A  15
ARG A  16
 None
None
None
GSH  A 301 (-4.2A)
 0.75A 3n9jB-1u3iA:
23.5		 3n9jB-1u3iA:
23.74
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 6 ARG A  16
LEU A  69
PRO A  54
SER A  71
 GSH  A 301 (-4.2A)
None
GSH  A 301 (-4.4A)
GSH  A 301 (-2.4A)
 1.35A 3vlnA-1u3iA:
17.2		 3vlnA-1u3iA:
23.60
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.
4Y0Q_A_PX9A201_1
(BETA-LACTOGLOBULIN)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		3 / 3 LYS A  57
ILE A   9
ILE A  36
 None
 0.68A 4y0qA-1u3iA:
undetectable		 4y0qA-1u3iA:
25.11
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.
5JW1_A_CELA602_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 6 VAL A   8
LEU A 161
SER A  19
ILE A 164
 None
 1.05A 5jw1A-1u3iA:
undetectable		 5jw1A-1u3iA:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KC0_A_RBFA303_2
(RIBOFLAVIN
TRANSPORTER RIBU)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		3 / 3 LYS A  80
LEU A  24
ILE A  74
 None
 0.69A 5kc0A-1u3iA:
2.6		 5kc0A-1u3iA:
22.90
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.
5W97_J_CHDJ101_1
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.22A 5w97J-1u3iA:
0.0		 5w97J-1u3iA:
16.23
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.
5X19_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.18A 5x19J-1u3iA:
undetectable		 5x19J-1u3iA:
16.23
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.
5X1B_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.24A 5x1bJ-1u3iA:
undetectable		 5x1bJ-1u3iA:
16.23
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.
5X1B_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.26A 5x1bW-1u3iA:
undetectable		 5x1bW-1u3iA:
16.23
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.
5X1F_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.18A 5x1fW-1u3iA:
0.0		 5x1fW-1u3iA:
16.23
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.
6CK2_C_IPHC101_0
(INSULIN A CHAIN
INSULIN B CHAIN)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 4 ILE A  20
LEU A 161
HIS A  82
ALA A  26
 None
 1.03A 6ck2C-1u3iA:
undetectable
6ck2D-1u3iA:
undetectable		 6ck2C-1u3iA:
9.09
6ck2D-1u3iA:
6.22
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.
6MA6_A_MYTA603_0
(CYTOCHROME P450 3A4)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 6 ARG A  16
ALA A  75
THR A  23
ALA A 165
 GSH  A 301 (-4.2A)
None
None
None
 1.14A 6ma6A-1u3iA:
0.0		 6ma6A-1u3iA:
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.
6NKN_J_CHDJ102_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.24A 6nknJ-1u3iA:
undetectable		 6nknJ-1u3iA:
16.23
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.
6NKN_W_CHDW102_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1u3i GLUTATHIONE
S-TRANSFERASE 28 KDA
(Schistosoma
mansoni) 		4 / 5 TYR A  92
MET A  85
THR A 157
LEU A 158
 None
 1.29A 6nknW-1u3iA:
0.0		 6nknW-1u3iA:
16.23