SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1pqu'

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.
1D4Y_A_TPVA501_1
(PROTEIN (HIV-1
PROTEASE))		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.92A 1d4yA-1pquA:
undetectable		 1d4yA-1pquA:
14.02
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.
1P2Y_A_NCTA440_1
(CYTOCHROME P450-CAM)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		4 / 7 VAL A  13
GLY A  14
ASP A  97
VAL A 362
 NAP  A1372 (-3.7A)
None
None
None
 0.79A 1p2yA-1pquA:
undetectable		 1p2yA-1pquA:
21.05
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.
1UWH_B_BAXB1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		4 / 6 ILE A 283
VAL A 154
VAL A 119
ILE A 109
 None
 0.81A 1uwhB-1pquA:
undetectable		 1uwhB-1pquA:
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.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 SER A  15
THR A  37
GLN A  74
 None
NAP  A1372 (-2.9A)
NAP  A1372 (-3.0A)
 0.74A 2fk8A-1pquA:
undetectable		 2fk8A-1pquA:
20.74
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.
2FUM_D_MIXD3539_2
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 VAL A 115
VAL A 111
ASP A 352
 None
 0.67A 2fumD-1pquA:
undetectable		 2fumD-1pquA:
22.02
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.
2O4P_A_TPVA300_1
(PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 11 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.95A 2o4pA-1pquA:
undetectable		 2o4pA-1pquA:
15.09
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.
2VDY_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 VAL A 154
GLN A 279
THR A 349
PHE A 281
ILE A 157
 None
 1.46A 2vdyA-1pquA:
0.0		 2vdyA-1pquA:
21.46
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.
2Y7W_B_SALB1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 THR A  72
ILE A   7
GLY A   8
GLY A  75
THR A  79
 None
None
NAP  A1372 (-3.1A)
NAP  A1372 (-3.4A)
None
 1.15A 2y7wB-1pquA:
undetectable		 2y7wB-1pquA:
22.05
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.
3LZV_A_017A200_1
(HIV-1 PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.93A 3lzvA-1pquA:
undetectable		 3lzvA-1pquA:
15.09
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.
3OXW_D_017D200_1
(HIV-1 PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 1.00A 3oxwC-1pquA:
undetectable		 3oxwC-1pquA:
14.82
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.
3OY4_B_017B200_2
(HIV-1 PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.98A 3oy4B-1pquA:
undetectable		 3oy4B-1pquA:
15.09
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.
3QT0_A_486A4_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 ARG A 270
SER A 166
ALA A 168
LEU A 176
ILE A 271
 CYS  A1374 (-2.5A)
NAP  A1372 (-4.8A)
CYS  A1374 ( 4.8A)
None
None
 1.38A 3qt0A-1pquA:
0.0		 3qt0A-1pquA:
22.42
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.
4DQB_B_017B101_2
(ASPARTYL PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.98A 4dqbB-1pquA:
undetectable		 4dqbB-1pquA:
15.09
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.
4DQE_B_017B101_2
(ASPARTYL PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.97A 4dqeB-1pquA:
undetectable		 4dqeB-1pquA:
15.09
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.
4DQH_B_017B101_2
(WILD-TYPE HIV-1
PROTEASE DIMER)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 10 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.99A 4dqhB-1pquA:
undetectable		 4dqhB-1pquA:
14.56
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.
4OKB_A_198A1002_1
(ANDROGEN RECEPTOR)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 LEU A  30
LEU A  17
MET A  18
MET A  21
ILE A   7
 None
 1.24A 4okbA-1pquA:
0.0		 4okbA-1pquA:
22.84
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.
4Q1W_A_017A104_1
(ASPARTYL PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 9 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.99A 4q1wA-1pquA:
undetectable		 4q1wA-1pquA:
15.63
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.
4XTA_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 9 SER A 166
ALA A 168
LEU A 176
LEU A 223
ILE A 271
 NAP  A1372 (-4.8A)
CYS  A1374 ( 4.8A)
None
None
None
 1.23A 4xtaA-1pquA:
undetectable		 4xtaA-1pquA:
22.94
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.
5ERS_A_ACTA803_0
(GEPHYRIN)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 THR A  79
ALA A 101
ASN A  80
 None
 0.60A 5ersA-1pquA:
2.6		 5ersA-1pquA:
23.99
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.
5L6E_B_ACTB401_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT
N6-ADENOSINE-METHYLT
RANSFERASE SUBUNIT
METTL14)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		4 / 6 GLU A 360
ARG A  20
LEU A  17
ARG A 363
 None
 1.07A 5l6eA-1pquA:
undetectable
5l6eB-1pquA:
undetectable		 5l6eA-1pquA:
20.27
5l6eB-1pquA:
23.53
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.
5N0O_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 ALA A  99
GLN A  74
THR A  79
 NAP  A1372 (-3.2A)
NAP  A1372 (-3.0A)
None
 0.63A 5n0oA-1pquA:
undetectable		 5n0oA-1pquA:
20.51
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.
5ODQ_A_ACTA703_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		4 / 6 ARG A 364
ARG A  20
ALA A 359
PRO A 361
 None
 1.24A 5odqA-1pquA:
2.0		 5odqA-1pquA:
20.27
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.
5OS7_A_ACTA402_0
(CASEIN KINASE II
SUBUNIT ALPHA)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 HIS A 118
SER A 121
LYS A 125
 None
 1.50A 5os7A-1pquA:
0.2		 5os7A-1pquA:
19.74
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.
5Z6J_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 MET A 143
ASP A 113
ARG A  20
 None
 1.14A 5z6jA-1pquA:
1.6		 5z6jA-1pquA:
19.09
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.
5Z6K_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 MET A 143
ASP A 113
ARG A  20
 None
 1.08A 5z6kA-1pquA:
0.0		 5z6kA-1pquA:
19.09
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_0
(PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.93A 6dgxA-1pquA:
undetectable		 6dgxA-1pquA:
14.33
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.
6DH6_A_017A104_0
(PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.95A 6dh6A-1pquA:
undetectable		 6dh6A-1pquA:
14.33
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.
6DIL_B_TPVB201_0
(HIV-1 PROTEASE)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		5 / 12 LEU A 354
ALA A  98
ASP A  97
GLY A   8
VAL A  16
 NAP  A1372 (-4.3A)
NAP  A1372 ( 4.0A)
None
NAP  A1372 (-3.1A)
None
 0.94A 6dilA-1pquA:
undetectable		 6dilA-1pquA:
13.75
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.
6EU9_D_READ601_1
(RETINOIC ACID
RECEPTOR)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		4 / 7 VAL A  16
LEU A 328
GLY A 326
GLY A 167
 None
None
None
CYS  A1374 (-3.1A)
 0.71A 6eu9D-1pquA:
0.0		 6eu9D-1pquA:
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.
6GMD_B_ACTB402_0
(CASEIN KINASE II
SUBUNIT ALPHA)		 1pqu ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE
(Haemophilus
influenzae) 		3 / 3 HIS A 118
SER A 121
LYS A 125
 None
 1.50A 6gmdB-1pquA:
0.2		 6gmdB-1pquA:
19.74