SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2we8'

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.
1JLF_A_NVPA999_1
(HIV-1 RT A-CHAIN
HIV-1 RT B-CHAIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 VAL A 103
TYR A  64
GLY A  25
TYR A  81
 None
GOL  A1366 (-3.7A)
None
None
 1.07A 1jlfA-2we8A:
undetectable
1jlfB-2we8A:
undetectable		 1jlfA-2we8A:
20.45
1jlfB-2we8A:
21.26
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.
1LWE_A_NVPA999_1
(HIV-1 REVERSE
TRANSCRIPTASE)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 VAL A 103
TYR A  64
GLY A  25
TYR A  81
 None
GOL  A1366 (-3.7A)
None
None
 1.02A 1lweA-2we8A:
undetectable		 1lweA-2we8A:
20.28
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.
1N13_B_AG2B7011_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 GLU A 179
ARG A 189
LEU A 172
ASP A 168
 None
 1.06A 1n13B-2we8A:
undetectable
1n13C-2we8A:
undetectable		 1n13B-2we8A:
15.03
1n13C-2we8A:
9.33
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.
1N13_L_AG2L7014_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 LEU A 172
ASP A 168
GLU A 179
ARG A 189
 None
 1.06A 1n13I-2we8A:
undetectable
1n13L-2we8A:
undetectable		 1n13I-2we8A:
9.33
1n13L-2we8A:
15.03
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.
1PK9_C_2FAC308_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 SER A 178
VAL A 180
GLU A 179
SER A 199
ILE A 133
 None
 1.17A 1pk9C-2we8A:
2.6		 1pk9C-2we8A:
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.
2UYQ_A_SAMA1311_0
(HYPOTHETICAL PROTEIN
ML2640)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 ALA A  34
ASP A 100
LEU A  99
ARG A  80
 None
 0.80A 2uyqA-2we8A:
4.4		 2uyqA-2we8A:
24.42
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.
2VUF_A_FUAA2002_1
(SERUM ALBUMIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 9 ILE A 350
PHE A 215
ALA A 216
VAL A 219
 None
 0.84A 2vufA-2we8A:
undetectable		 2vufA-2we8A:
20.13
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.
3AQI_A_CHDA3_0
(FERROCHELATASE)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 PRO A 256
LEU A 288
ARG A 313
 None
 0.82A 3aqiA-2we8A:
5.1		 3aqiA-2we8A:
20.33
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.
3AQI_B_CHDB5_0
(FERROCHELATASE)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 PRO A 256
LEU A 288
ARG A 313
 None
 0.83A 3aqiB-2we8A:
3.5		 3aqiB-2we8A:
20.33
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.
3FPJ_B_SAMB301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLY A 171
THR A 149
GLU A 179
ALA A 174
 None
 0.72A 3fpjB-2we8A:
7.2		 3fpjB-2we8A:
21.04
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.
3MG0_K_BO2K1402_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 THR A  26
ALA A  40
VAL A   8
ALA A  22
GLY A  23
 None
 0.94A 3mg0K-2we8A:
undetectable
3mg0L-2we8A:
undetectable		 3mg0K-2we8A:
21.81
3mg0L-2we8A:
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.
3UFN_A_ROCA401_2
(HIV-1 PROTEASE)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLY A 142
ILE A 141
VAL A 180
VAL A  28
 None
 0.71A 3ufnB-2we8A:
undetectable		 3ufnB-2we8A:
14.51
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.
4AC9_C_DXCC1478_0
(MJ0495-LIKE PROTEIN)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLY A  25
THR A  26
THR A 110
PHE A 111
 None
 1.03A 4ac9C-2we8A:
7.4		 4ac9C-2we8A:
22.33
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.
4LTW_A_486A302_1
(ANCESTRAL STEROID
RECEPTOR 2)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 LEU A 295
VAL A 291
GLN A 263
ILE A 269
ALA A 268
 None
 1.04A 4ltwA-2we8A:
undetectable		 4ltwA-2we8A:
19.59
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.
4WG0_C_CHDC102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 GLU A 319
LEU A 317
LEU A 327
LEU A 330
 None
None
None
ACT  A1368 (-4.5A)
 0.75A 4wg0B-2we8A:
undetectable
4wg0C-2we8A:
undetectable		 4wg0B-2we8A:
2.79
4wg0C-2we8A:
2.79
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.
4WG0_L_CHDL103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		4 / 7 LEU A 327
LEU A 330
GLU A 319
LEU A 317
 None
ACT  A1368 (-4.5A)
None
None
 0.77A 4wg0L-2we8A:
undetectable
4wg0M-2we8A:
undetectable		 4wg0L-2we8A:
2.79
4wg0M-2we8A:
2.79
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.
4WNW_B_RTZB602_1
(CYTOCHROME P450 2D6)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 PHE A 111
GLY A  10
LEU A   9
ALA A  22
VAL A   5
 None
 0.98A 4wnwB-2we8A:
undetectable		 4wnwB-2we8A:
22.60
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.
5IL1_A_SAMA601_0
(METTL3)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ASP A 270
ILE A 269
PRO A 296
GLU A 265
GLY A 267
 None
 1.35A 5il1A-2we8A:
1.8		 5il1A-2we8A:
18.57
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.
5K7U_A_SAMA601_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ASP A 270
ILE A 269
PRO A 296
GLU A 265
GLY A 267
 None
 1.35A 5k7uA-2we8A:
undetectable		 5k7uA-2we8A:
18.57
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.
6AWP_A_FVXA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 ILE A 350
SER A 306
SER A 332
SER A 331
GLY A 302
 None
None
ACT  A1368 (-4.4A)
None
None
 1.16A 6awpA-2we8A:
undetectable		 6awpA-2we8A:
22.12
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.
6BXM_A_SAMA402_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 LEU A 327
LEU A 208
VAL A 274
ARG A 329
ASP A 297
 None
 0.93A 6bxmA-2we8A:
3.3		 6bxmA-2we8A:
23.88
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.
6CZM_A_HISA402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 GLY A  10
LEU A   9
VAL A  15
VAL A  43
LEU A 114
 None
 1.05A 6czmA-2we8A:
undetectable
6czmC-2we8A:
undetectable		 6czmA-2we8A:
24.07
6czmC-2we8A:
24.07
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.
6CZM_A_HISA402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		6 / 10 GLY A 171
LEU A 172
VAL A 196
VAL A 147
ALA A 130
LEU A 181
 None
 1.01A 6czmA-2we8A:
undetectable
6czmC-2we8A:
undetectable		 6czmA-2we8A:
24.07
6czmC-2we8A:
24.07
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.
6CZM_B_HISB402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A  43
LEU A 114
GLY A  10
LEU A   9
VAL A  15
 None
 1.02A 6czmA-2we8A:
undetectable
6czmB-2we8A:
undetectable		 6czmA-2we8A:
24.07
6czmB-2we8A:
24.07
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.
6CZM_B_HISB402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A 196
VAL A 147
LEU A 181
GLY A 171
LEU A 172
 None
 0.83A 6czmA-2we8A:
undetectable
6czmB-2we8A:
undetectable		 6czmA-2we8A:
24.07
6czmB-2we8A:
24.07
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.
6CZM_C_HISC402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A  43
LEU A 114
GLY A  10
LEU A   9
VAL A  15
 None
 1.07A 6czmB-2we8A:
undetectable
6czmC-2we8A:
undetectable		 6czmB-2we8A:
24.07
6czmC-2we8A:
24.07
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.
6CZM_C_HISC402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A 196
VAL A 147
LEU A 181
GLY A 171
LEU A 172
 None
 0.86A 6czmB-2we8A:
undetectable
6czmC-2we8A:
undetectable		 6czmB-2we8A:
24.07
6czmC-2we8A:
24.07
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.
6CZM_E_HISE402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A  43
LEU A 114
GLY A  10
LEU A   9
VAL A  15
 None
 1.09A 6czmD-2we8A:
undetectable
6czmE-2we8A:
undetectable		 6czmD-2we8A:
24.07
6czmE-2we8A:
24.07
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.
6CZM_E_HISE402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 VAL A 196
VAL A 147
LEU A 181
GLY A 171
LEU A 172
 None
 0.84A 6czmD-2we8A:
undetectable
6czmE-2we8A:
undetectable		 6czmD-2we8A:
24.07
6czmE-2we8A:
24.07
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.
6CZM_F_HISF402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 VAL A  43
LEU A 114
GLY A  10
LEU A   9
VAL A  15
 None
 1.07A 6czmE-2we8A:
undetectable
6czmF-2we8A:
undetectable		 6czmE-2we8A:
24.07
6czmF-2we8A:
24.07
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.
6CZM_F_HISF402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 2we8 XANTHINE
DEHYDROGENASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 VAL A 196
VAL A 147
LEU A 181
GLY A 171
LEU A 172
 None
 0.86A 6czmE-2we8A:
undetectable
6czmF-2we8A:
undetectable		 6czmE-2we8A:
24.07
6czmF-2we8A:
24.07