SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4xkm'

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.
1XID_A_ASCA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 10 HIS A 103
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.45A 1xidA-4xkmA:
40.0		 1xidA-4xkmA:
28.69
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.
1XID_A_ASCA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 10 TRP A  51
HIS A 103
PHE A 147
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.34A 1xidA-4xkmA:
40.0		 1xidA-4xkmA:
28.69
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.
1XIH_A_SORA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 103
THR A 143
TRP A 190
ASP A 309
ASP A 298
 None
None
None
MN  A 502 (-3.3A)
MN  A 501 (-3.2A)
 1.40A 1xihA-4xkmA:
40.0		 1xihA-4xkmA:
28.69
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.
1XIH_A_SORA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.38A 1xihA-4xkmA:
40.0		 1xihA-4xkmA:
28.69
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.
1XIH_A_SORA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 12 TRP A  51
HIS A 103
THR A 143
PHE A 147
VAL A 188
TRP A 190
LYS A 236
ASP A 309
ASP A 341
 None
None
None
None
None
None
None
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.81A 1xihA-4xkmA:
40.0		 1xihA-4xkmA:
28.69
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.
1XIH_A_SORA389_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
HIS A 103
THR A 143
PHE A 147
VAL A 188
TRP A 190
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.43A 1xihA-4xkmA:
40.0		 1xihA-4xkmA:
28.69
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.
2UVN_B_ECNB1406_1
(CYTOCHROME P450 130)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 11 PRO A 314
GLY A 302
THR A 275
LEU A 320
VAL A 271
 None
 1.49A 2uvnB-4xkmA:
undetectable		 2uvnB-4xkmA:
21.07
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.
2W3A_A_TOPA1190_1
(DIHYDROFOLATE
REDUCTASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 156
GLU A 194
PHE A 189
ILE A 176
THR A 158
 None
 1.18A 2w3aA-4xkmA:
undetectable		 2w3aA-4xkmA:
18.16
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.
2XIN_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
HIS A 273
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-2.9A)
 1.43A 2xinA-4xkmA:
39.2		 2xinA-4xkmA:
28.09
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.
2XIN_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.59A 2xinA-4xkmA:
39.2		 2xinA-4xkmA:
28.09
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.
2XIN_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		8 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 309
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.2A)
 1.35A 2xinB-4xkmA:
39.0		 2xinB-4xkmA:
28.09
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.
2XIN_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.66A 2xinB-4xkmA:
39.0		 2xinB-4xkmA:
28.09
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.
2XIN_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		8 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 309
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.2A)
 1.32A 2xinC-4xkmA:
39.1		 2xinC-4xkmA:
28.09
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.
2XIN_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		8 / 12 HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 311
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-2.9A)
 1.50A 2xinC-4xkmA:
39.1		 2xinC-4xkmA:
28.09
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.
2XIN_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 THR A 143
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 341
 None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.1A)
 1.21A 2xinC-4xkmA:
39.1		 2xinC-4xkmA:
28.09
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.
2XIN_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.62A 2xinC-4xkmA:
39.1		 2xinC-4xkmA:
28.09
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.
2XIN_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		8 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 309
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.2A)
 1.31A 2xinD-4xkmA:
39.1		 2xinD-4xkmA:
28.09
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.
2XIN_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
HIS A 273
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 502 (-2.9A)
 1.42A 2xinD-4xkmA:
39.1		 2xinD-4xkmA:
28.09
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.
2XIN_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.65A 2xinD-4xkmA:
39.1		 2xinD-4xkmA:
28.09
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.
2XRL_A_DXTA1211_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 243
PRO A 235
THR A 251
VAL A 252
LEU A 256
 None
 1.28A 2xrlA-4xkmA:
1.2		 2xrlA-4xkmA:
20.04
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.
2YVL_B_SAMB602_1
(HYPOTHETICAL PROTEIN)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 118
ASP A 177
TYR A 221
 None
 0.82A 2yvlB-4xkmA:
undetectable		 2yvlB-4xkmA:
20.87
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.
3B0W_A_DGXA1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 211
ALA A 218
ALA A 156
VAL A 146
LEU A 121
 None
 1.30A 3b0wA-4xkmA:
undetectable		 3b0wA-4xkmA:
19.60
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.
3HRD_E_NIOE5660_1
(NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		3 / 3 GLU A 270
GLU A 234
TRP A  51
 MN  A 502 ( 2.5A)
MN  A 501 (-2.5A)
None
 1.16A 3hrdA-4xkmA:
undetectable
3hrdE-4xkmA:
undetectable
3hrdF-4xkmA:
undetectable		 3hrdA-4xkmA:
23.79
3hrdE-4xkmA:
23.79
3hrdF-4xkmA:
21.12
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.
3IHT_A_SAMA200_0
(S-ADENOSYL-L-METHION
INE METHYL
TRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLY A 295
ASN A 291
GLY A 292
ASP A 298
LEU A 232
 None
None
None
MN  A 501 (-3.2A)
None
 0.93A 3ihtA-4xkmA:
undetectable		 3ihtA-4xkmA:
16.59
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.
3LJG_A_HAEA301_1
(MACROPHAGE
METALLOELASTASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 5 ILE A 253
HIS A 279
GLU A 284
HIS A 283
 None
 0.99A 3ljgA-4xkmA:
undetectable		 3ljgA-4xkmA:
15.89
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.
3ONN_A_ACTA271_0
(PROTEIN SSM1)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 5 GLY A 397
LYS A 398
GLU A 401
GLY A 394
 None
 0.84A 3onnA-4xkmA:
undetectable		 3onnA-4xkmA:
18.78
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.
3TWP_A_SALA404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ALA A 144
TYR A 152
ARG A 193
ALA A 156
 None
 1.10A 3twpA-4xkmA:
undetectable		 3twpA-4xkmA:
22.37
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.
3XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.36A 3ximA-4xkmA:
39.1		 3ximA-4xkmA:
27.88
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.
3XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 270
ASP A 298
ASP A 311
 None
None
None
MN  A 502 ( 2.5A)
MN  A 501 (-3.2A)
MN  A 502 (-2.9A)
 1.31A 3ximA-4xkmA:
39.1		 3ximA-4xkmA:
27.88
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.
3XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.58A 3ximA-4xkmA:
39.1		 3ximA-4xkmA:
27.88
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.
3XIM_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.36A 3ximB-4xkmA:
39.0		 3ximB-4xkmA:
27.88
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.
3XIM_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.36A 3ximB-4xkmA:
39.0		 3ximB-4xkmA:
27.88
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.
3XIM_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.58A 3ximB-4xkmA:
39.0		 3ximB-4xkmA:
27.88
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.
3XIM_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 311
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.29A 3ximC-4xkmA:
39.0		 3ximC-4xkmA:
27.88
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.
3XIM_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.51A 3ximC-4xkmA:
39.0		 3ximC-4xkmA:
27.88
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.
3XIM_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.30A 3ximD-4xkmA:
39.1		 3ximD-4xkmA:
27.88
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.
3XIM_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 298
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 501 (-3.2A)
MN  A 502 (-2.9A)
 1.29A 3ximD-4xkmA:
39.1		 3ximD-4xkmA:
27.88
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.
3XIM_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.53A 3ximD-4xkmA:
39.1		 3ximD-4xkmA:
27.88
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.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 10 HIS A  52
ASP A 311
ASP A 309
PRO A 237
HIS A 273
 None
MN  A 502 (-2.9A)
MN  A 502 (-3.3A)
None
MN  A 502 (-4.2A)
 1.50A 4bz6A-4xkmA:
undetectable		 4bz6A-4xkmA:
20.63
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.
4DVO_A_SORA404_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
VAL A 188
ASN A 268
GLU A 270
ASP A 311
 None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.45A 4dvoA-4xkmA:
40.0		 4dvoA-4xkmA:
28.45
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.
4DVO_A_SORA404_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A 143
TRP A 190
GLU A 270
HIS A 273
ASP A 341
 None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.1A)
 1.34A 4dvoA-4xkmA:
40.0		 4dvoA-4xkmA:
28.45
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.
4DVO_A_SORA404_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
LYS A 236
ASN A 268
GLU A 270
HIS A 273
ASP A 298
ASP A 309
 None
None
None
None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
 0.48A 4dvoA-4xkmA:
40.0		 4dvoA-4xkmA:
28.45
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.
4FEV_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.18A 4fevD-4xkmA:
undetectable		 4fevD-4xkmA:
20.82
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.
4FEV_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.21A 4fevF-4xkmA:
0.5		 4fevF-4xkmA:
20.82
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.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.20A 4fewD-4xkmA:
undetectable		 4fewD-4xkmA:
20.82
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.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.22A 4fewF-4xkmA:
undetectable		 4fewF-4xkmA:
20.82
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.
4GKH_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.18A 4gkhF-4xkmA:
undetectable		 4gkhF-4xkmA:
20.82
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.
4GKH_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.20A 4gkhG-4xkmA:
0.5		 4gkhG-4xkmA:
20.82
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.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 311
ASP A 106
ASN A 339
GLU A 234
 MN  A 502 (-2.9A)
None
None
MN  A 501 (-2.5A)
 1.20A 4gkiA-4xkmA:
0.5		 4gkiA-4xkmA:
20.82
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.
4XIA_A_SORA400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 HIS A 103
THR A 143
TRP A 190
ASP A 309
ASP A 298
 None
None
None
MN  A 502 (-3.3A)
MN  A 501 (-3.2A)
 1.37A 4xiaA-4xkmA:
38.9		 4xiaA-4xkmA:
26.72
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.
4XIA_A_SORA400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.35A 4xiaA-4xkmA:
38.9		 4xiaA-4xkmA:
26.72
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.
4XIA_A_SORA400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		8 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
LYS A 236
ASP A 309
ASP A 341
 None
None
None
None
None
None
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.82A 4xiaA-4xkmA:
38.9		 4xiaA-4xkmA:
26.72
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.
4XIA_A_SORA400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		10 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.45A 4xiaA-4xkmA:
38.9		 4xiaA-4xkmA:
26.72
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.
4XIA_B_SORB400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.33A 4xiaB-4xkmA:
38.8		 4xiaB-4xkmA:
26.72
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.
4XIA_B_SORB400_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.46A 4xiaB-4xkmA:
38.8		 4xiaB-4xkmA:
26.72
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.
4XP1_A_LDPA708_1
(DOPAMINE
TRANSPORTER, ISOFORM
B)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 10 PHE A 340
ALA A 364
ASP A 363
TYR A  29
GLY A 361
 None
 1.09A 4xp1A-4xkmA:
undetectable		 4xp1A-4xkmA:
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.
5IGY_A_ERYA403_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 327
GLY A 332
ASN A 330
ALA A 288
PHE A 340
 None
 1.11A 5igyA-4xkmA:
undetectable		 5igyA-4xkmA:
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.
5KF8_A_GCSA404_1
(PREDICTED
ACETYLTRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 TRP A 190
GLU A 234
ASP A 311
TRP A  51
 None
MN  A 501 (-2.5A)
MN  A 502 (-2.9A)
None
 1.01A 5kf8A-4xkmA:
0.9		 5kf8A-4xkmA:
20.81
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.
5KGJ_A_X6XA402_1
(PREDICTED
ACETYLTRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 5 TRP A 190
GLU A 234
ASP A 311
TRP A  51
 None
MN  A 501 (-2.5A)
MN  A 502 (-2.9A)
None
 1.00A 5kgjA-4xkmA:
0.8		 5kgjA-4xkmA:
20.81
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.
5KGP_A_GCSA407_1
(PREDICTED
ACETYLTRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 TRP A 190
GLU A 234
ASP A 311
TRP A  51
 None
MN  A 501 (-2.5A)
MN  A 502 (-2.9A)
None
 0.93A 5kgpA-4xkmA:
1.2		 5kgpA-4xkmA:
20.81
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.
5KGP_B_GCSB405_1
(PREDICTED
ACETYLTRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 8 TRP A 190
GLU A 234
ASP A 311
TRP A  51
 None
MN  A 501 (-2.5A)
MN  A 502 (-2.9A)
None
 0.95A 5kgpB-4xkmA:
0.6		 5kgpB-4xkmA:
20.81
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.
5KOC_B_SAMB401_0
(PAVINE
N-METHYLTRANSFERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLY A 142
THR A 179
VAL A 125
VAL A 105
LEU A 107
 None
 1.19A 5kocB-4xkmA:
undetectable		 5kocB-4xkmA:
22.00
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.
5MQT_C_STIC302_1
(DEOXYCYTIDINE KINASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLU A 378
MET A 325
GLU A 282
LEU A 434
GLU A 370
 None
 1.18A 5mqtC-4xkmA:
1.4		 5mqtC-4xkmA:
19.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_A_SORA503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 9 HIS A 103
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.41A 5nhaA-4xkmA:
66.3		 5nhaA-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_A_SORA503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A  51
HIS A 103
TRP A 141
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.18A 5nhaA-4xkmA:
66.3		 5nhaA-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_B_SORB503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 9 HIS A 103
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.40A 5nhaB-4xkmA:
66.3		 5nhaB-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_B_SORB503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A  51
HIS A 103
TRP A 141
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.17A 5nhaB-4xkmA:
66.3		 5nhaB-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_C_SORC503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 9 HIS A 103
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.40A 5nhaC-4xkmA:
66.2		 5nhaC-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_C_SORC503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A  51
HIS A 103
TRP A 141
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.17A 5nhaC-4xkmA:
66.2		 5nhaC-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_D_SORD503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 9 HIS A 103
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.41A 5nhaD-4xkmA:
66.2		 5nhaD-4xkmA:
83.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NHA_D_SORD503_0
(XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		9 / 9 TRP A  51
HIS A 103
TRP A 141
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 501 (-3.1A)
 0.17A 5nhaD-4xkmA:
66.2		 5nhaD-4xkmA:
83.33
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.
5XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.31A 5ximA-4xkmA:
39.1		 5ximA-4xkmA:
27.88
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.
5XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.34A 5ximA-4xkmA:
39.1		 5ximA-4xkmA:
27.88
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.
5XIM_A_SORA397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.53A 5ximA-4xkmA:
39.1		 5ximA-4xkmA:
27.88
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.
5XIM_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.38A 5ximB-4xkmA:
39.0		 5ximB-4xkmA:
27.88
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.
5XIM_B_SORB397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.61A 5ximB-4xkmA:
39.0		 5ximB-4xkmA:
27.88
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.
5XIM_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		7 / 12 HIS A 103
THR A 143
TRP A 190
GLU A 234
GLU A 270
HIS A 273
ASP A 298
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
 1.30A 5ximC-4xkmA:
39.0		 5ximC-4xkmA:
27.88
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.
5XIM_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		6 / 12 HIS A 103
THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 311
 None
None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.35A 5ximC-4xkmA:
39.0		 5ximC-4xkmA:
27.88
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.
5XIM_C_SORC397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		12 / 12 TRP A  51
HIS A 103
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.53A 5ximC-4xkmA:
39.0		 5ximC-4xkmA:
27.88
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.
5XIM_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A 143
VAL A 188
GLU A 234
GLU A 270
ASP A 311
 None
None
MN  A 501 (-2.5A)
MN  A 502 ( 2.5A)
MN  A 502 (-2.9A)
 1.26A 5ximD-4xkmA:
39.1		 5ximD-4xkmA:
27.88
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.
5XIM_D_SORD397_0
(D-XYLOSE ISOMERASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		11 / 12 TRP A  51
THR A 143
VAL A 188
TRP A 190
GLU A 234
LYS A 236
GLU A 270
HIS A 273
ASP A 298
ASP A 309
ASP A 341
 None
None
None
None
MN  A 501 (-2.5A)
None
MN  A 502 ( 2.5A)
MN  A 502 (-4.2A)
MN  A 501 (-3.2A)
MN  A 502 (-3.3A)
MN  A 501 (-3.1A)
 0.55A 5ximD-4xkmA:
39.1		 5ximD-4xkmA:
27.88
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.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A 357
THR A  53
ALA A  47
THR A 338
ALA A 299
 None
 1.32A 6h1lB-4xkmA:
undetectable		 6h1lB-4xkmA:
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.
6HU9_Q_PCFQ202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 6 TYR A 152
ALA A 166
ARG A 167
ASP A 104
 None
 1.14A 6hu9m-4xkmA:
undetectable
6hu9q-4xkmA:
undetectable		 6hu9m-4xkmA:
19.43
6hu9q-4xkmA:
16.14
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.
6MN5_F_LLLF301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4xkm XYLOSE ISOMERASE
(Bacteroides
thetaiotaomicron) 		4 / 5 ASP A 309
GLU A 234
ASP A 298
CYH A 101
 MN  A 502 (-3.3A)
MN  A 501 (-2.5A)
MN  A 501 (-3.2A)
None
 1.33A 6mn5F-4xkmA:
0.0		 6mn5F-4xkmA:
13.66