SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1yqd'

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.
1D4S_A_TPVA201_2
(PROTEIN (HIV-1
PROTEASE))		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 8 ALA A 144
GLY A 101
ILE A 121
VAL A  96
 None
 0.76A 1d4sB-1yqdA:
undetectable		 1d4sB-1yqdA:
15.49
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.
1EE2_B_CHDB1250_1
(ALCOHOL
DEHYDROGENASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 11 CYH A  50
SER A  52
HIS A  72
LEU A 122
CYH A 166
 ZN  A1000 (-2.3A)
DTT  A 700 (-2.4A)
ZN  A1000 ( 3.3A)
None
ZN  A1000 ( 2.3A)
 0.78A 1ee2B-1yqdA:
34.9		 1ee2B-1yqdA:
25.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JHO_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.30A 1jhoA-1yqdA:
2.4		 1jhoA-1yqdA:
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.
1JHO_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.25A 1jhoA-1yqdA:
2.4		 1jhoA-1yqdA:
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.
1JHQ_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 8 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.29A 1jhqA-1yqdA:
2.4		 1jhqA-1yqdA:
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.
1JHQ_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 8 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.25A 1jhqA-1yqdA:
2.4		 1jhqA-1yqdA:
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.
1JHR_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.29A 1jhrA-1yqdA:
2.5		 1jhrA-1yqdA:
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.
1JHR_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.24A 1jhrA-1yqdA:
2.5		 1jhrA-1yqdA:
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.
1JHV_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 8 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.21A 1jhvA-1yqdA:
2.4		 1jhvA-1yqdA:
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.
1JHY_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.27A 1jhyA-1yqdA:
2.4		 1jhyA-1yqdA:
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.
1JHY_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.25A 1jhyA-1yqdA:
2.4		 1jhyA-1yqdA:
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.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.27A 1l4nA-1yqdA:
2.5		 1l4nA-1yqdA:
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.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.23A 1l4nA-1yqdA:
2.5		 1l4nA-1yqdA:
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.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.28A 1l5kA-1yqdA:
2.5		 1l5kA-1yqdA:
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.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.26A 1l5kA-1yqdA:
2.5		 1l5kA-1yqdA:
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.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.32A 1l5lA-1yqdA:
2.2		 1l5lA-1yqdA:
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.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.24A 1l5lA-1yqdA:
2.2		 1l5lA-1yqdA:
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.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.32A 1l5mA-1yqdA:
2.7		 1l5mA-1yqdA:
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.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 170
GLY A 302
LEU A 195
SER A  52
GLY A 278
 NAP  A 500 (-3.1A)
NAP  A 500 (-3.2A)
NAP  A 500 (-3.4A)
DTT  A 700 (-2.4A)
NAP  A 500 (-3.4A)
 1.25A 1l5mA-1yqdA:
2.7		 1l5mA-1yqdA:
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.
1MRJ_A_ADNA300_1
(ALPHA-TRICHOSANTHIN)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 8 ILE A 303
GLY A  97
TYR A 148
GLU A 114
 NAP  A 500 (-4.3A)
None
None
None
 0.82A 1mrjA-1yqdA:
undetectable		 1mrjA-1yqdA:
21.39
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.
2AB2_B_SNLB503_2
(MINERALOCORTICOID
RECEPTOR)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 5 LEU A 264
LEU A 274
LEU A 286
LEU A 284
 None
 1.01A 2ab2B-1yqdA:
undetectable		 2ab2B-1yqdA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HC4_A_VDXA525_1
(VITAMIN D RECEPTOR)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 12 LEU A 195
CYH A  50
HIS A 259
LEU A 284
LEU A 264
 NAP  A 500 (-3.4A)
ZN  A1000 (-2.3A)
None
None
None
 1.30A 2hc4A-1yqdA:
undetectable		 2hc4A-1yqdA:
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.
2QD4_A_CHDA802_0
(FERROCHELATASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 6 ARG A  33
ARG A  32
VAL A  69
MET A  65
 None
 1.34A 2qd4A-1yqdA:
3.2		 2qd4A-1yqdA:
22.79
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.
2WA2_B_SAMB1267_0
(NON-STRUCTURAL
PROTEIN 5)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 12 SER A 216
GLY A 196
GLY A 191
VAL A 171
THR A 170
 NAP  A 500 (-2.6A)
None
NAP  A 500 (-3.4A)
None
NAP  A 500 (-3.1A)
 0.96A 2wa2B-1yqdA:
4.3		 2wa2B-1yqdA:
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.
2ZLC_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 12 LEU A 195
CYH A  50
HIS A 259
LEU A 284
LEU A 264
 NAP  A 500 (-3.4A)
ZN  A1000 (-2.3A)
None
None
None
 1.34A 2zlcA-1yqdA:
undetectable		 2zlcA-1yqdA:
20.22
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.
3EL4_A_ROCA100_1
(PROTEASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 12 GLY A 161
ALA A 162
ILE A  74
GLY A  76
VAL A 350
 None
 0.83A 3el4A-1yqdA:
undetectable		 3el4A-1yqdA:
12.95
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.
3EM6_A_017A200_1
(PROTEASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 8 ALA A 323
ASP A 324
GLY A 196
LEU A 195
VAL A  49
 None
None
None
NAP  A 500 (-3.4A)
None
 1.41A 3em6A-1yqdA:
undetectable		 3em6A-1yqdA:
12.57
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.
3NY4_A_SMXA310_1
(BETA-LACTAMASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 8 LEU A 333
ALA A 359
THR A 360
GLY A 137
 None
 0.94A 3ny4A-1yqdA:
undetectable		 3ny4A-1yqdA:
20.26
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.
3WSJ_A_MK1A201_1
(PROTEASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 ARG A 348
ASP A 331
VAL A 353
LEU A 357
ILE A 351
 NAP  A 500 (-3.1A)
None
None
None
None
 1.35A 3wsjA-1yqdA:
undetectable		 3wsjA-1yqdA:
17.00
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.
4C9K_A_CAMA424_0
(CYTOCHROME P450)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 THR A 211
LEU A 268
LEU A 248
GLY A 250
VAL A 190
 None
 1.37A 4c9kA-1yqdA:
undetectable		 4c9kA-1yqdA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FOG_D_C2FD302_0
(THYMIDYLATE SYNTHASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 11 ILE A 275
LEU A 248
GLY A 179
PHE A 178
ALA A 203
 None
 1.26A 4fogD-1yqdA:
undetectable		 4fogD-1yqdA:
21.27
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.
4KLR_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		4 / 8 LEU A 340
SER A 216
VAL A 198
GLY A 196
 NAP  A 500 ( 4.8A)
NAP  A 500 (-2.6A)
None
None
 1.00A 4klrB-1yqdA:
3.1		 4klrB-1yqdA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KQI_A_NIOA403_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 9 GLY A 294
GLY A 266
PHE A 265
LEU A 268
GLY A 246
 None
 1.22A 4kqiA-1yqdA:
2.1		 4kqiA-1yqdA:
22.28
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.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 11 PHE A 152
VAL A 350
TYR A  46
GLY A  95
GLY A 161
 None
 1.25A 4xp4A-1yqdA:
0.1		 4xp4A-1yqdA:
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.
4XPB_A_COCA702_1
(TRANSPORTER)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 PHE A 152
VAL A 350
TYR A  46
GLY A  95
GLY A 161
 None
 1.31A 4xpbA-1yqdA:
0.0		 4xpbA-1yqdA:
21.88
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.
5AXD_A_RBVA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		3 / 3 THR A 309
HIS A  51
LEU A 195
 None
NAP  A 500 (-3.8A)
NAP  A 500 (-3.4A)
 0.77A 5axdA-1yqdA:
7.9		 5axdA-1yqdA:
20.76
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.
5AXD_C_RBVC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		3 / 3 THR A 309
HIS A  51
LEU A 195
 None
NAP  A 500 (-3.8A)
NAP  A 500 (-3.4A)
 0.73A 5axdC-1yqdA:
8.0		 5axdC-1yqdA:
20.76
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.
5Y7P_B_CHDB401_0
(BILE SALT HYDROLASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 LEU A 357
ILE A  74
LEU A  68
ALA A  17
LEU A  25
 None
 1.16A 5y7pB-1yqdA:
undetectable		 5y7pB-1yqdA:
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.
5Y7P_D_CHDD401_0
(BILE SALT HYDROLASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 LEU A 357
ILE A  74
LEU A  68
ALA A  17
LEU A  25
 None
 1.15A 5y7pD-1yqdA:
undetectable		 5y7pD-1yqdA:
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.
5Y7P_G_CHDG401_0
(BILE SALT HYDROLASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 LEU A 357
ILE A  74
LEU A  68
ALA A  17
LEU A  25
 None
 1.13A 5y7pG-1yqdA:
undetectable		 5y7pG-1yqdA:
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.
5Y7P_H_CHDH401_0
(BILE SALT HYDROLASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 LEU A 357
ILE A  74
LEU A  68
ALA A  17
LEU A  25
 None
 1.14A 5y7pH-1yqdA:
undetectable		 5y7pH-1yqdA:
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.
6DGX_A_017A101_2
(PROTEASE)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		3 / 3 GLY A 278
ASP A 253
ILE A 189
 NAP  A 500 (-3.4A)
None
None
 0.46A 6dgxB-1yqdA:
undetectable		 6dgxB-1yqdA:
11.23
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.
6DWD_D_GLYD713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		3 / 3 ARG A  32
HIS A   9
ARG A  33
 None
 1.14A 6dwdD-1yqdA:
0.0		 6dwdD-1yqdA:
20.90
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.
6NQA_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 1yqd SINAPYL ALCOHOL
DEHYDROGENASE
(Populus
tremuloides) 		5 / 10 THR A 330
GLY A  71
GLY A  48
VAL A 353
GLU A  73
 None
 1.22A 6nqaK-1yqdA:
4.4		 6nqaK-1yqdA:
21.38