SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2q50'

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.
1HXB_A_ROCA100_1
(HIV-1 PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.87A 1hxbA-2q50A:
undetectable		 1hxbA-2q50A:
15.95
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.
1MX1_E_THAE5_1
(LIVER
CARBOXYLESTERASE I)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 LEU A 317
GLY A  54
VAL A   9
VAL A  63
LEU A  88
 None
 1.06A 1mx1E-2q50A:
undetectable		 1mx1E-2q50A:
22.08
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.
1SDV_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 11 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.30A 1sdvB-2q50A:
undetectable		 1sdvB-2q50A:
17.01
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.
1YA4_C_CTXC3_2
(CES1 PROTEIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 4 LEU A 254
PRO A 127
ILE A 241
LEU A 268
 None
 1.11A 1ya4C-2q50A:
undetectable		 1ya4C-2q50A:
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.
1YAJ_G_BEZG3385_0
(CES1 PROTEIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		3 / 3 SER A 306
VAL A  11
LEU A  56
 None
 0.71A 1yajG-2q50A:
undetectable		 1yajG-2q50A:
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.
2AVO_B_MK1B902_2
(POL POLYPROTEIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.28A 2avoB-2q50A:
undetectable		 2avoB-2q50A:
17.01
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.
2BPX_B_MK1B902_2
(HIV-1 PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.29A 2bpxB-2q50A:
undetectable		 2bpxB-2q50A:
17.01
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.
2DRD_A_MIYA2001_1
(ACRB)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 9 GLY A 162
GLU A 191
ILE A 158
ALA A 215
VAL A 213
 None
 1.39A 2drdA-2q50A:
undetectable		 2drdA-2q50A:
16.30
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.
2F8G_B_017B401_2
(POL POLYPROTEIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.79A 2f8gB-2q50A:
undetectable		 2f8gB-2q50A:
16.67
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.
2O4K_A_DR7A301_2
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.35A 2o4kB-2q50A:
undetectable		 2o4kB-2q50A:
17.36
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.
2O4L_A_TPVA403_2
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.44A 2o4lB-2q50A:
undetectable		 2o4lB-2q50A:
17.71
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.
2Q64_B_1UNB1001_3
(PROTEASE RETROPEPSIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.35A 2q64B-2q50A:
undetectable		 2q64B-2q50A:
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.
2QAK_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.88A 2qakA-2q50A:
undetectable		 2qakA-2q50A:
17.01
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.
3JB3_A_SAMA1102_1
(STRUCTURAL PROTEIN
VP3)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		3 / 3 ARG A 163
ASP A 109
ASP A 105
 None
 0.87A 3jb3A-2q50A:
3.2		 3jb3A-2q50A:
16.47
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.
3JW2_A_017A401_2
(GAG-POL POLYPROTEIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.38A 3jw2B-2q50A:
undetectable		 3jw2B-2q50A:
17.01
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.
3K4V_B_ROCB201_3
(HIV-1 PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.34A 3k4vB-2q50A:
undetectable		 3k4vB-2q50A:
14.94
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.
3N58_C_ADNC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 5 LEU A 181
GLN A 178
THR A 155
GLU A 198
 None
 1.46A 3n58C-2q50A:
10.0		 3n58C-2q50A:
22.80
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.
3NU5_B_478B401_1
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.79A 3nu5A-2q50A:
undetectable		 3nu5A-2q50A:
16.67
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.
3NXU_A_RITA600_2
(CYTOCHROME P450 3A4)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 ARG A 171
ILE A 168
THR A 121
THR A 301
 None
 0.90A 3nxuA-2q50A:
undetectable		 3nxuA-2q50A:
22.55
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.
3R9V_B_DXCB323_0
(INVASIN IPAD)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 LEU A 151
ILE A 241
ILE A 243
LEU A 118
 None
 0.67A 3r9vA-2q50A:
undetectable
3r9vB-2q50A:
undetectable		 3r9vA-2q50A:
22.02
3r9vB-2q50A:
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.
3TKW_B_017B401_2
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 12 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.85A 3tkwB-2q50A:
undetectable		 3tkwB-2q50A:
15.85
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.
3TL9_A_ROCA401_3
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.39A 3tl9B-2q50A:
undetectable		 3tl9B-2q50A:
15.85
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.
4ASD_A_BAXA1500_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 6 ILE A 168
VAL A 214
CYH A 226
ILE A 241
 None
 0.75A 4asdA-2q50A:
undetectable		 4asdA-2q50A:
23.23
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.
4DX7_A_DM2A1106_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 11 SER A 154
PHE A 175
LEU A 119
ALA A 215
ARG A 170
 None
 1.30A 4dx7A-2q50A:
0.0		 4dx7A-2q50A:
16.19
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.
4JEC_B_478B401_1
(HIV-1 PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.34A 4jecA-2q50A:
undetectable		 4jecA-2q50A:
17.01
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.
4NJV_D_RITD500_1
(PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 11 GLY A  72
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 0.92A 4njvC-2q50A:
undetectable		 4njvC-2q50A:
16.77
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.
4R38_C_RBFC201_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		5 / 9 THR A 103
LEU A  56
VAL A  63
LEU A  88
ILE A  78
 None
 1.20A 4r38C-2q50A:
undetectable		 4r38C-2q50A:
18.04
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.
4XTA_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 9 CYH A  29
ALA A  22
LEU A 313
LEU A  56
 None
 0.89A 4xtaA-2q50A:
undetectable		 4xtaA-2q50A:
25.98
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.
5EU8_B_010B6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
MAIN PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 5 ASN A 312
LEU A  56
THR A 103
CYH A  57
 None
 1.42A 5eu8A-2q50A:
0.0		 5eu8A-2q50A:
20.29
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.
5VC0_A_RITA602_2
(CYTOCHROME P450 3A4)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 ARG A 171
ILE A 168
THR A 121
THR A 301
 None
 0.83A 5vc0A-2q50A:
undetectable		 5vc0A-2q50A:
22.45
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_C_CHDC302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 LEU A 107
THR A  80
TYR A 102
HIS A  62
 None
 1.22A 5w97C-2q50A:
undetectable
5w97a-2q50A:
undetectable
5w97c-2q50A:
undetectable		 5w97C-2q50A:
22.87
5w97a-2q50A:
22.80
5w97c-2q50A:
22.87
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_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 THR A  80
TYR A 102
HIS A  62
LEU A 107
 None
 1.21A 5x1fA-2q50A:
undetectable
5x1fC-2q50A:
undetectable
5x1fP-2q50A:
undetectable		 5x1fA-2q50A:
22.80
5x1fC-2q50A:
22.87
5x1fP-2q50A:
22.87
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.
5Z84_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 LEU A 107
THR A  80
TYR A 102
HIS A  62
 None
 1.23A 5z84C-2q50A:
undetectable
5z84N-2q50A:
undetectable
5z84P-2q50A:
undetectable		 5z84C-2q50A:
22.87
5z84N-2q50A:
22.80
5z84P-2q50A:
22.87
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.
5Z85_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 7 LEU A 107
THR A  80
TYR A 102
HIS A  62
 None
 1.26A 5z85C-2q50A:
undetectable
5z85N-2q50A:
undetectable
5z85P-2q50A:
undetectable		 5z85C-2q50A:
22.87
5z85N-2q50A:
22.80
5z85P-2q50A:
22.87
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.
6A7P_B_9SCB601_1
(SERUM ALBUMIN)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		4 / 6 ASN A 250
PHE A 231
LEU A 282
SER A 272
 None
 1.45A 6a7pB-2q50A:
undetectable		 6a7pB-2q50A:
19.18
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_1
(HIV-1 PROTEASE)		 2q50 GLYOXYLATE
REDUCTASE/HYDROXYPYR
UVATE REDUCTASE
(Homo
sapiens) 		6 / 12 GLY A  72
ALA A  71
VAL A  63
ILE A  78
GLY A  54
ILE A  67
 None
 1.42A 6dilB-2q50A:
undetectable		 6dilB-2q50A:
17.23