SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1t1s'

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.
1GTN_C_TRPC81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 THR A 282
ALA A 122
ALA A  99
THR A  16
ILE A   5
 None
 1.22A 1gtnB-1t1sA:
undetectable
1gtnC-1t1sA:
undetectable		 1gtnB-1t1sA:
10.46
1gtnC-1t1sA:
10.46
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.
1IE4_B_T44B328_1
(TRANSTHYRETIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 LEU A   6
GLU A  76
ALA A  31
THR A   4
 None
 0.90A 1ie4B-1t1sA:
undetectable
1ie4D-1t1sA:
undetectable		 1ie4B-1t1sA:
15.58
1ie4D-1t1sA:
15.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KIJ_B_NOVB444_1
(DNA GYRASE SUBUNIT B)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ILE A 279
ASP A 274
ILE A  12
ALA A  99
THR A 282
 None
 1.25A 1kijB-1t1sA:
undetectable		 1kijB-1t1sA:
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.
2I30_A_SALA1100_1
(SERUM ALBUMIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 6 HIS A 208
TYR A 314
ARG A 190
GLY A 184
 SO4  A1001 (-3.8A)
None
None
SO4  A1001 (-3.2A)
 1.40A 2i30A-1t1sA:
0.0		 2i30A-1t1sA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZMA_A_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 ALA A 308
TYR A 311
ILE A 249
TYR A 314
 None
 1.05A 2zmaA-1t1sA:
undetectable		 2zmaA-1t1sA:
22.35
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.
3B9M_A_SALA1200_1
(SERUM ALBUMIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 5 HIS A 208
TYR A 314
ARG A 190
GLY A 184
 SO4  A1001 (-3.8A)
None
None
SO4  A1001 (-3.2A)
 1.31A 3b9mA-1t1sA:
0.0		 3b9mA-1t1sA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DTU_C_DXCC576_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 PRO A 108
ALA A 112
ALA A 115
THR A   4
 None
 0.86A 3dtuC-1t1sA:
undetectable
3dtuD-1t1sA:
undetectable		 3dtuC-1t1sA:
20.51
3dtuD-1t1sA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BUP_B_SAMB500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 SER A 253
GLY A 187
ALA A 222
SER A 212
GLU A 151
 SO4  A1001 ( 4.8A)
None
None
None
CBQ  A2001 ( 3.0A)
 1.44A 4bupB-1t1sA:
undetectable		 4bupB-1t1sA:
20.00
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.
4C9P_B_CAMB423_0
(CYTOCHROME P450)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 THR A 332
LEU A 127
GLY A 131
VAL A 374
VAL A 377
 None
 1.31A 4c9pB-1t1sA:
0.0		 4c9pB-1t1sA:
21.97
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.
4CX7_A_H4BA600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 8 SER A   8
ARG A  21
ILE A   5
PHE A  48
 None
 1.27A 4cx7A-1t1sA:
undetectable
4cx7B-1t1sA:
undetectable		 4cx7A-1t1sA:
20.04
4cx7B-1t1sA:
20.04
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.
4E0F_A_RBFA301_1
(RIBOFLAVIN SYNTHASE
SUBUNIT ALPHA)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 SER A   8
VAL A  96
LEU A   6
ALA A  88
VAL A  93
 None
 1.22A 4e0fA-1t1sA:
undetectable		 4e0fA-1t1sA:
20.88
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.
4IB4_A_ERMA2001_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 7 THR A 332
LEU A 110
ASN A 123
LEU A 121
 None
 0.95A 4ib4A-1t1sA:
undetectable		 4ib4A-1t1sA:
22.67
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.
4J6C_A_STRA501_1
(CYTOCHROME P450
MONOOXYGENASE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ALA A 333
ALA A 336
ALA A 337
THR A 341
VAL A 392
 None
 1.11A 4j6cA-1t1sA:
undetectable		 4j6cA-1t1sA:
25.51
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.
4J6C_B_STRB503_1
(CYTOCHROME P450
MONOOXYGENASE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 10 ALA A 333
ALA A 336
ALA A 337
THR A 341
VAL A 392
 None
 1.09A 4j6cB-1t1sA:
undetectable		 4j6cB-1t1sA:
25.51
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.
4KOV_A_KOVA204_1
(UNCHARACTERIZED
PROTEIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 12 ASN A 226
MET A 225
ILE A 355
ARG A 215
LEU A 346
 CBQ  A2001 (-3.9A)
None
None
None
None
 1.35A 4kovA-1t1sA:
undetectable		 4kovA-1t1sA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KOY_A_CSCA214_1
(UNCHARACTERIZED
PROTEIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		5 / 11 ASN A 226
MET A 225
ILE A 355
ARG A 215
LEU A 346
 CBQ  A2001 (-3.9A)
None
None
None
None
 1.34A 4koyA-1t1sA:
0.5		 4koyA-1t1sA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QTU_D_SAMD301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 5 GLN A 164
LEU A 159
SER A 158
ASP A 274
 None
 1.04A 4qtuD-1t1sA:
4.7		 4qtuD-1t1sA:
20.35
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.
5HHJ_A_GLYA403_0
(RETRON-TYPE REVERSE
TRANSCRIPTASE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 4 LEU A 301
LEU A 270
GLY A 271
GLU A 272
 None
 1.25A 5hhjA-1t1sA:
0.0		 5hhjA-1t1sA:
20.49
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.
5ZW2_A_ACTA511_0
(L-PROLYL-[PEPTIDYL-C
ARRIER PROTEIN]
DEHYDROGENASE)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		3 / 3 ARG A 190
ILE A 249
SER A 185
 None
None
SO4  A1001 (-2.5A)
 0.77A 5zw2A-1t1sA:
undetectable		 5zw2A-1t1sA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CI6_A_NBOA607_1
(SERUM ALBUMIN)		 1t1s 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE
(Escherichia
coli) 		4 / 7 ASP A 149
ALA A 122
LYS A 124
LEU A 127
 MG  A1002 ( 3.3A)
None
CBQ  A2001 ( 3.1A)
None
 0.86A 6ci6A-1t1sA:
undetectable		 6ci6A-1t1sA:
13.09