SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2avd'

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.
1NH8_A_HISA289_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 5 ASP A 185
LEU A 120
ALA A 209
LEU A 211
 SAM  A 501 (-3.4A)
None
None
None
 1.09A 1nh8A-2avdA:
undetectable		 1nh8A-2avdA:
23.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2AVD_A_SAMA501_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		12 / 12 MET A  85
MET A  86
GLY A 110
PHE A 112
TYR A 115
SER A 116
VAL A 135
ALA A 163
ALA A 186
ASP A 187
TYR A 194
ARG A 212
 SAM  A 501 (-4.6A)
SAM  A 501 (-4.2A)
SAM  A 501 (-3.4A)
SAM  A 501 (-4.7A)
None
SAM  A 501 (-3.0A)
SAM  A 501 (-4.3A)
SAM  A 501 (-3.5A)
SAM  A 501 (-3.7A)
SAM  A 501 (-3.8A)
None
SAM  A 501 (-4.0A)
 0.00A 2avdA-2avdA:
43.5		 2avdA-2avdA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		6 / 12 GLY A 110
PHE A 112
ALA A 163
ALA A 186
TYR A 194
ARG A 212
 SAM  A 501 (-3.4A)
SAM  A 501 (-4.7A)
SAM  A 501 (-3.5A)
SAM  A 501 (-3.7A)
None
SAM  A 501 (-4.0A)
 1.27A 2avdB-2avdA:
39.2		 2avdB-2avdA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		11 / 12 SER A  84
MET A  85
MET A  86
GLY A 110
PHE A 112
TYR A 115
VAL A 135
ALA A 163
ASP A 185
ALA A 186
TYR A 194
 None
SAM  A 501 (-4.6A)
SAM  A 501 (-4.2A)
SAM  A 501 (-3.4A)
SAM  A 501 (-4.7A)
None
SAM  A 501 (-4.3A)
SAM  A 501 (-3.5A)
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
None
 0.66A 2avdB-2avdA:
39.2		 2avdB-2avdA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 SER A 116
GLU A 134
ASP A 187
 SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.8A)
 0.09A 2avdB-2avdA:
40.7		 2avdB-2avdA:
100.00
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.
2B25_B_SAMB602_1
(HYPOTHETICAL PROTEIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 GLY A 110
GLU A 134
ASP A 185
 SAM  A 501 (-3.4A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.19A 2b25B-2avdA:
15.0		 2b25B-2avdA:
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 11 ALA A 103
ALA A  98
LEU A 120
ALA A 119
VAL A 130
 None
 1.11A 2bxeB-2avdA:
undetectable		 2bxeB-2avdA:
17.57
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.
2QO5_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 9 TYR A 115
LEU A  69
ALA A  91
MET A  63
LEU A  74
 None
 1.29A 2qo5A-2avdA:
0.0		 2qo5A-2avdA:
21.08
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.
2VQ5_B_LDPB1197_1
(S-NORCOCLAURINE
SYNTHASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 7 LEU A  97
LEU A 100
LEU A 258
TYR A 246
 None
 0.78A 2vq5B-2avdA:
undetectable		 2vq5B-2avdA:
21.24
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.24A 2zthA-2avdA:
20.4		 2zthA-2avdA:
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.
3A7E_A_SAMA216_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 6 GLY A 110
SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.4A)
SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.35A 3a7eA-2avdA:
20.9		 3a7eA-2avdA:
23.40
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.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.19A 3bwmA-2avdA:
21.0		 3bwmA-2avdA:
22.98
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.20A 3bwyA-2avdA:
21.0		 3bwyA-2avdA:
22.98
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.
3EEO_A_SAMA328_0
(MODIFICATION
METHYLASE HHAI)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 12 PHE A 179
LEU A  94
ASP A 108
ASP A 157
LEU A 170
 None
None
SAM  A 501 ( 4.7A)
None
None
 1.22A 3eeoA-2avdA:
undetectable		 3eeoA-2avdA:
21.90
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.
4KUK_A_RBFA201_2
(BLUE-LIGHT
PHOTORECEPTOR)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 9 MET A  86
LEU A 120
ILE A 156
PHE A 112
GLY A 110
 SAM  A 501 (-4.2A)
None
None
SAM  A 501 (-4.7A)
SAM  A 501 (-3.4A)
 1.10A 4kukA-2avdA:
undetectable		 4kukA-2avdA:
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.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.19A 4xudA-2avdA:
20.7		 4xudA-2avdA:
22.36
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.
4XUE_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 5 GLY A 110
TYR A 115
SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.40A 4xueA-2avdA:
21.0		 4xueA-2avdA:
22.69
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.
4YMG_A_SAMA1001_0
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		6 / 12 MET A  85
GLY A 110
TYR A 115
ALA A 163
ALA A 186
TYR A 194
 SAM  A 501 (-4.6A)
SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.5A)
SAM  A 501 (-3.7A)
None
 0.59A 4ymgA-2avdA:
24.7		 4ymgA-2avdA:
27.86
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.
4YMG_B_SAMB1001_0
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		8 / 12 MET A  85
GLY A 110
TYR A 115
SER A 116
ALA A 163
ASP A 185
ALA A 186
TYR A 194
 SAM  A 501 (-4.6A)
SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.0A)
SAM  A 501 (-3.5A)
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
None
 0.63A 4ymgB-2avdA:
24.3		 4ymgB-2avdA:
27.86
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.
5HPU_A_IPHA101_0
(INSULIN, CHAIN A
INSULIN, CHAIN B)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 4 CYH A 198
LEU A 109
LEU A 167
ALA A 163
 None
None
None
SAM  A 501 (-3.5A)
 0.98A 5hpuA-2avdA:
undetectable
5hpuB-2avdA:
undetectable		 5hpuA-2avdA:
7.46
5hpuB-2avdA:
8.48
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.
5HRQ_I_IPHI101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 6 VAL A 184
LEU A 208
CYH A 191
LEU A 235
 None
 1.17A 5hrqB-2avdA:
undetectable
5hrqI-2avdA:
undetectable
5hrqJ-2avdA:
undetectable		 5hrqB-2avdA:
8.48
5hrqI-2avdA:
7.46
5hrqJ-2avdA:
8.48
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.
5HWK_A_BEZA301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 10 GLY A 255
GLY A 253
LEU A 256
LEU A  93
GLU A  89
 None
 1.42A 5hwkA-2avdA:
undetectable		 5hwkA-2avdA:
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.
5HWK_B_BEZB301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 10 GLY A 255
GLY A 253
LEU A 256
LEU A  93
GLU A  89
 None
 1.41A 5hwkB-2avdA:
undetectable		 5hwkB-2avdA:
20.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5KVA_A_SAMA301_0
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		6 / 12 GLY A 110
ALA A 163
ASP A 185
ALA A 186
ASP A 187
TYR A 194
 SAM  A 501 (-3.4A)
SAM  A 501 (-3.5A)
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
SAM  A 501 (-3.8A)
None
 0.48A 5kvaA-2avdA:
30.6		 5kvaA-2avdA:
33.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5KVA_A_SAMA301_0
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		6 / 12 GLY A 110
TYR A 115
ASP A 185
ALA A 186
ASP A 187
TYR A 194
 SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
SAM  A 501 (-3.8A)
None
 0.61A 5kvaA-2avdA:
30.6		 5kvaA-2avdA:
33.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5KVA_B_SAMB301_0
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		7 / 12 GLY A 110
TYR A 115
ALA A 163
ASP A 185
ALA A 186
ASP A 187
TYR A 194
 SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.5A)
SAM  A 501 (-3.4A)
SAM  A 501 (-3.7A)
SAM  A 501 (-3.8A)
None
 0.69A 5kvaB-2avdA:
30.6		 5kvaB-2avdA:
33.33
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.
5LSA_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 4 TYR A 115
SER A 116
GLU A 134
ASP A 185
 None
SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.35A 5lsaA-2avdA:
21.1		 5lsaA-2avdA:
22.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5N5D_A_SAMA306_0
(METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 12 GLY A 110
TYR A 115
ALA A 163
ALA A 186
TYR A 194
 SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.5A)
SAM  A 501 (-3.7A)
None
 0.62A 5n5dA-2avdA:
28.4		 5n5dA-2avdA:
34.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5N5D_A_SAMA306_1
(METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 7 PHE A 112
SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-4.7A)
SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.28A 5n5dA-2avdA:
28.4		 5n5dA-2avdA:
34.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5N5D_B_SAMB303_1
(METHYLTRANSFERASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 7 GLY A 110
PHE A 112
SER A 116
GLU A 134
ASP A 185
 SAM  A 501 (-3.4A)
SAM  A 501 (-4.7A)
SAM  A 501 (-3.0A)
SAM  A 501 (-2.9A)
SAM  A 501 (-3.4A)
 0.25A 5n5dB-2avdA:
28.6		 5n5dB-2avdA:
34.60
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.
5UUN_A_ACTA310_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 GLU A 153
HIS A 154
ARG A 129
 None
 0.73A 5uunA-2avdA:
undetectable		 5uunA-2avdA:
23.28
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.
5Y7P_E_CHDE401_0
(BILE SALT HYDROLASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		4 / 8 LEU A 249
LEU A 258
ALA A 259
LEU A 208
 None
 0.85A 5y7pE-2avdA:
undetectable		 5y7pE-2avdA:
19.81
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.
5ZCP_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 7 LEU A 120
TYR A 115
ARG A  73
MET A  86
THR A  87
 None
None
None
SAM  A 501 (-4.2A)
None
 1.47A 5zcpA-2avdA:
undetectable
5zcpJ-2avdA:
undetectable		 5zcpA-2avdA:
18.02
5zcpJ-2avdA:
10.96
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.
5ZW4_A_SAMA302_0
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 12 MET A  86
GLY A 110
TYR A 115
ALA A 163
ALA A 186
 SAM  A 501 (-4.2A)
SAM  A 501 (-3.4A)
None
SAM  A 501 (-3.5A)
SAM  A 501 (-3.7A)
 0.72A 5zw4A-2avdA:
24.7		 5zw4A-2avdA:
28.24
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.
6AG0_C_ACRC608_1
(ALPHA-AMYLASE)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		3 / 3 TYR A 115
ALA A 121
LEU A 122
 None
 0.64A 6ag0C-2avdA:
undetectable		 6ag0C-2avdA:
17.50
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.
6GNG_A_QPSA601_1
(-)		 2avd CATECHOL-O-METHYLTRA
NSFERASE
(Homo
sapiens) 		5 / 12 LEU A  77
THR A 111
GLY A 110
ASP A 185
ASP A  83
 None
None
SAM  A 501 (-3.4A)
SAM  A 501 (-3.4A)
None
 1.03A 6gngA-2avdA:
3.5		 6gngA-2avdA:
16.64