SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2xsr'

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.
1EQB_A_FFOA1293_1
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		3 / 3 GLU A 102
TYR A 106
PHE A 223
 None
 0.70A 1eqbB-2xsrA:
undetectable		 1eqbB-2xsrA:
21.79
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.
1EQB_B_FFOB2293_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		3 / 3 GLU A 102
TYR A 106
PHE A 223
 None
 0.70A 1eqbA-2xsrA:
undetectable		 1eqbA-2xsrA:
21.79
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.
1EQB_C_FFOC3293_2
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		3 / 3 GLU A 102
TYR A 106
PHE A 223
 None
 0.69A 1eqbD-2xsrA:
undetectable		 1eqbD-2xsrA:
21.79
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.
1EQB_D_FFOD4293_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		3 / 3 GLU A 102
TYR A 106
PHE A 223
 None
 0.71A 1eqbC-2xsrA:
undetectable		 1eqbC-2xsrA:
21.79
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.
1S9A_A_BEZA306_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		8 / 11 ILE A 101
GLY A 103
PRO A 104
TYR A 161
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
None
FE  A1307 (-4.3A)
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.57A 1s9aA-2xsrA:
27.7		 1s9aA-2xsrA:
27.99
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.
1S9A_A_BEZA306_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 11 LEU A  69
ILE A 101
GLY A 103
PRO A 104
TYR A 161
 None
None
None
None
FE  A1307 (-4.3A)
 1.27A 1s9aA-2xsrA:
27.7		 1s9aA-2xsrA:
27.99
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.
1S9A_A_BEZA306_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		8 / 11 LEU A  69
ILE A 101
GLY A 103
PRO A 104
TYR A 161
TYR A 195
HIS A 219
HIS A 221
 None
None
None
None
FE  A1307 (-4.3A)
None
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.47A 1s9aA-2xsrA:
27.7		 1s9aA-2xsrA:
27.99
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.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		8 / 12 ILE A 101
GLY A 103
PRO A 104
TYR A 161
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
None
FE  A1307 (-4.3A)
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.48A 1s9aB-2xsrA:
27.7		 1s9aB-2xsrA:
27.99
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.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		7 / 12 ILE A 101
GLY A 103
TYR A 195
ARG A 216
HIS A 219
HIS A 221
GLN A 235
 None
None
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
None
 0.92A 1s9aB-2xsrA:
27.7		 1s9aB-2xsrA:
27.99
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.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		8 / 12 LEU A  69
ILE A 101
GLY A 103
PRO A 104
TYR A 161
TYR A 195
HIS A 219
HIS A 221
 None
None
None
None
FE  A1307 (-4.3A)
None
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.47A 1s9aB-2xsrA:
27.7		 1s9aB-2xsrA:
27.99
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.
1S9A_B_BEZB307_0
(CHLOROCATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		7 / 12 LEU A  69
ILE A 101
GLY A 103
TYR A 195
HIS A 219
HIS A 221
GLN A 235
 None
None
None
None
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
None
 0.87A 1s9aB-2xsrA:
27.7		 1s9aB-2xsrA:
27.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		7 / 11 GLY A 103
PRO A 104
TYR A 161
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
FE  A1307 (-4.3A)
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.59A 1tmxA-2xsrA:
27.7		 1tmxA-2xsrA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_A_BEZA881_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 11 LEU A  69
GLY A 103
ARG A 216
HIS A 219
HIS A 221
 None
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.99A 1tmxA-2xsrA:
27.7		 1tmxA-2xsrA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		7 / 12 GLY A 103
PRO A 104
TYR A 161
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
FE  A1307 (-4.3A)
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.49A 1tmxB-2xsrA:
27.0		 1tmxB-2xsrA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		6 / 12 GLY A 103
PRO A 104
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 1.45A 1tmxB-2xsrA:
27.0		 1tmxB-2xsrA:
30.98
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.
1XQL_B_4AXB505_1
(ALANINE RACEMASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 8 TYR A 161
TYR A 195
PHE A 248
CYH A 197
 FE  A1307 (-4.3A)
None
None
None
 1.36A 1xqlA-2xsrA:
undetectable
1xqlB-2xsrA:
undetectable		 1xqlA-2xsrA:
23.00
1xqlB-2xsrA:
23.00
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.
2IGT_B_SAMB1002_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 PHE A 223
ALA A 249
PRO A 104
GLY A  73
TYR A 106
 None
 1.16A 2igtB-2xsrA:
undetectable		 2igtB-2xsrA:
23.86
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.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 PHE A 223
ALA A 249
PRO A 104
GLY A  73
TYR A 106
 None
 1.13A 2igtC-2xsrA:
undetectable		 2igtC-2xsrA:
23.86
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.
2ZJ0_A_2FAA500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.26A 2zj0A-2xsrA:
undetectable		 2zj0A-2xsrA:
22.66
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.
2ZJ0_B_2FAB500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.35A 2zj0B-2xsrA:
undetectable		 2zj0B-2xsrA:
22.66
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.
2ZJ0_C_2FAC500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.29A 2zj0C-2xsrA:
undetectable		 2zj0C-2xsrA:
22.66
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.
2ZJ0_D_2FAD500_2
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 4 LEU A 244
GLN A 235
THR A 252
THR A 259
 None
 1.50A 2zj0D-2xsrA:
undetectable		 2zj0D-2xsrA:
22.66
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.
3CE6_A_ADNA500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.30A 3ce6A-2xsrA:
undetectable		 3ce6A-2xsrA:
22.50
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.
3CE6_B_ADNB500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.29A 3ce6B-2xsrA:
undetectable		 3ce6B-2xsrA:
22.50
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.
3CE6_C_ADNC500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.31A 3ce6C-2xsrA:
undetectable		 3ce6C-2xsrA:
22.50
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.
3CE6_D_ADND500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.29A 3ce6D-2xsrA:
undetectable		 3ce6D-2xsrA:
22.50
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.
3GLQ_A_RABA602_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.35A 3glqA-2xsrA:
undetectable		 3glqA-2xsrA:
23.39
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.
3GLQ_B_RABB602_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.36A 3glqB-2xsrA:
undetectable		 3glqB-2xsrA:
23.39
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.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		7 / 12 ILE A 101
PRO A 104
TYR A 161
TYR A 195
ARG A 216
HIS A 219
HIS A 221
 None
None
FE  A1307 (-4.3A)
None
FE  A1307 ( 4.7A)
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.58A 3hgiA-2xsrA:
28.3		 3hgiA-2xsrA:
29.30
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.
3HGI_A_BEZA284_0
(CATECHOL
1,2-DIOXYGENASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		8 / 12 LEU A  69
ILE A 101
GLY A 103
PRO A 104
TYR A 161
TYR A 195
HIS A 219
HIS A 221
 None
None
None
None
FE  A1307 (-4.3A)
None
FE  A1307 (-3.3A)
FE  A1307 (-3.2A)
 0.54A 3hgiA-2xsrA:
28.3		 3hgiA-2xsrA:
29.30
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.
3K4V_B_ROCB201_4
(HIV-1 PROTEASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 4 ARG A 272
ASP A 126
GLY A 122
THR A 189
 None
 1.33A 3k4vB-2xsrA:
undetectable		 3k4vB-2xsrA:
17.25
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.
3OND_A_ADNA506_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.33A 3ondA-2xsrA:
undetectable		 3ondA-2xsrA:
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.
3OND_B_ADNB507_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.33A 3ondB-2xsrA:
undetectable		 3ondB-2xsrA:
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.
3VAS_B_ADNB401_2
(PUTATIVE ADENOSINE
KINASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 5 LEU A  70
ALA A  72
THR A 203
PHE A 248
 PIE  A1308 ( 4.3A)
None
None
None
 1.24A 3vasB-2xsrA:
undetectable		 3vasB-2xsrA:
24.03
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.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 6 PHE A 236
ALA A 187
LEU A 131
THR A 189
 None
 1.02A 4dtzA-2xsrA:
undetectable		 4dtzA-2xsrA:
22.18
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.
4G0U_F_ASWF101_1
(DNA TOPOISOMERASE
2-BETA)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 6 ARG A 216
GLY A  73
GLU A  77
GLN A 204
 FE  A1307 ( 4.7A)
None
None
None
 1.11A 4g0uA-2xsrA:
undetectable		 4g0uA-2xsrA:
17.48
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.
4LVC_C_ADNC501_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.37A 4lvcC-2xsrA:
undetectable		 4lvcC-2xsrA:
23.30
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.
4PFJ_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.39A 4pfjB-2xsrA:
undetectable		 4pfjB-2xsrA:
21.54
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.
4PGF_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.39A 4pgfB-2xsrA:
undetectable		 4pgfB-2xsrA:
21.54
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.
4QB9_E_PARE500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 LEU A 232
THR A 233
SER A 297
GLU A  77
TYR A 106
 None
 1.42A 4qb9E-2xsrA:
undetectable		 4qb9E-2xsrA:
23.67
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.
5AXA_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 5axaA-2xsrA:
undetectable		 5axaA-2xsrA:
20.94
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.
5AXA_C_ADNC502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.33A 5axaC-2xsrA:
undetectable		 5axaC-2xsrA:
20.94
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.
5HM8_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8A-2xsrA:
undetectable		 5hm8A-2xsrA:
20.71
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.
5HM8_B_ADNB501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8B-2xsrA:
undetectable		 5hm8B-2xsrA:
20.71
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.
5HM8_C_ADNC501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8C-2xsrA:
undetectable		 5hm8C-2xsrA:
20.71
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.
5HM8_D_ADND501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8D-2xsrA:
undetectable		 5hm8D-2xsrA:
20.71
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.
5HM8_E_ADNE501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8E-2xsrA:
undetectable		 5hm8E-2xsrA:
20.71
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.
5HM8_F_ADNF501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8F-2xsrA:
undetectable		 5hm8F-2xsrA:
20.71
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.
5HM8_G_ADNG501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8G-2xsrA:
undetectable		 5hm8G-2xsrA:
20.71
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.
5HM8_H_ADNH501_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5hm8H-2xsrA:
undetectable		 5hm8H-2xsrA:
20.71
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.
5M5K_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.36A 5m5kA-2xsrA:
undetectable		 5m5kA-2xsrA:
23.30
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.
5M5K_C_ADNC502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.38A 5m5kC-2xsrA:
undetectable		 5m5kC-2xsrA:
23.30
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.
5M66_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.40A 5m66A-2xsrA:
undetectable		 5m66A-2xsrA:
23.30
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.
5M66_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.38A 5m66B-2xsrA:
undetectable		 5m66B-2xsrA:
23.30
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.
5M66_D_ADND502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 5m66D-2xsrA:
undetectable		 5m66D-2xsrA:
23.30
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.
5V96_A_ADNA502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.38A 5v96A-2xsrA:
undetectable		 5v96A-2xsrA:
22.20
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.
5V96_C_ADNC502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.36A 5v96C-2xsrA:
undetectable		 5v96C-2xsrA:
22.20
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.
5V96_D_ADND502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.37A 5v96D-2xsrA:
undetectable		 5v96D-2xsrA:
22.20
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.
5VLM_B_CVIB301_1
(REGULATORY PROTEIN
TETR)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		4 / 8 GLY A  75
ARG A 216
ASP A 247
ASP A  81
 None
FE  A1307 ( 4.7A)
None
None
 0.91A 5vlmB-2xsrA:
undetectable		 5vlmB-2xsrA:
19.12
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.
6AY4_A_TPFA506_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 10 TYR A 243
ALA A 251
PHE A 250
ALA A 249
CYH A 197
 None
 1.48A 6ay4A-2xsrA:
undetectable		 6ay4A-2xsrA:
22.67
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.
6EXI_A_ADNA502_0
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.43A 6exiA-2xsrA:
undetectable		 6exiA-2xsrA:
13.86
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.
6EXI_D_ADND502_0
(ADENOSYLHOMOCYSTEINA
SE)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.42A 6exiD-2xsrA:
undetectable		 6exiD-2xsrA:
13.86
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.
6F3M_B_ADNB502_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 6f3mB-2xsrA:
undetectable		 6f3mB-2xsrA:
22.17
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.
6F3M_D_ADND502_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 6f3mD-2xsrA:
undetectable		 6f3mD-2xsrA:
22.17
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.
6F3N_A_ADNA505_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 6f3nA-2xsrA:
undetectable		 6f3nA-2xsrA:
21.96
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.
6F3N_B_ADNB505_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 6f3nB-2xsrA:
undetectable		 6f3nB-2xsrA:
21.96
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.
6F3N_C_ADNC505_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.33A 6f3nC-2xsrA:
undetectable		 6f3nC-2xsrA:
21.96
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.
6F3N_D_ADND506_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.34A 6f3nD-2xsrA:
undetectable		 6f3nD-2xsrA:
21.96
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.
6GBN_A_ADNA501_1
(-)		 2xsr CATECHOL 1,2
DIOXYGENASE
(Acinetobacter
radioresistens) 		5 / 12 ASP A 246
LEU A 207
GLY A 214
HIS A 213
PHE A 250
 None
 1.38A 6gbnA-2xsrA:
undetectable		 6gbnA-2xsrA:
22.30