SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2p50'

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.
1E7W_B_MTXB301_1
(PTERIDINE REDUCTASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 11 ARG A 318
SER A  90
PRO A 277
ASP A  57
HIS A 251
None
1.21A 1e7wB-2p50A:
undetectable
1e7wB-2p50A:
22.96
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.
1ITU_A_CILA451_1
(RENAL DIPEPTIDASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLU A 131
HIS A 143
HIS A 195
HIS A 216
ASN A 219
ZN  A 601 (-2.3A)
None
ZN  A 601 (-3.3A)
ZN  A 601 (-3.4A)
None
1.08A 1ituA-2p50A:
15.5
1ituA-2p50A:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ITU_A_CILA451_1
(RENAL DIPEPTIDASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLU A 131
HIS A 143
HIS A 195
HIS A 216
ASP A 273
ZN  A 601 (-2.3A)
None
ZN  A 601 (-3.3A)
ZN  A 601 (-3.4A)
ZN  A 601 ( 4.5A)
1.13A 1ituA-2p50A:
15.5
1ituA-2p50A:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ITU_B_CILB452_1
(RENAL DIPEPTIDASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLU A 131
HIS A 143
HIS A 195
HIS A 216
ASP A 273
ZN  A 601 (-2.3A)
None
ZN  A 601 (-3.3A)
ZN  A 601 (-3.4A)
ZN  A 601 ( 4.5A)
1.17A 1ituB-2p50A:
14.4
1ituB-2p50A:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KGL_A_RTLA175_0
(CELLULAR
RETINOL-BINDING
PROTEIN TYPE I)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 PHE A 207
LEU A 200
ALA A 203
SER A 196
GLY A 233
None
1.03A 1kglA-2p50A:
undetectable
1kglA-2p50A:
17.20
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.
1LII_A_ADNA699_1
(ADENOSINE KINASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ILE A  23
LEU A  51
GLY A  26
GLY A 376
LEU A   4
None
0.88A 1liiA-2p50A:
2.7
1liiA-2p50A:
24.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OE2_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 GLU A 131
HIS A 195
HIS A 143
ZN  A 601 (-2.3A)
ZN  A 601 (-3.3A)
None
0.70A 1oe2A-2p50A:
undetectable
1oe2A-2p50A:
25.78
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.
1P93_B_DEXB2999_1
(GLUCOCORTICOID
RECEPTOR)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLY A 344
LEU A 349
ARG A 348
CYH A 269
PHE A 213
None
1.34A 1p93B-2p50A:
undetectable
1p93B-2p50A:
22.11
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.
1QVU_A_PRLA196_0
(TRANSCRIPTIONAL
REGULATOR QACR)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 6 LEU A 337
GLU A 346
THR A 212
TYR A 242
None
1.43A 1qvuA-2p50A:
undetectable
1qvuA-2p50A:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AKE_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 THR A  11
GLY A  12
GLY A 350
THR A 336
ILE A   9
None
1.37A 2akeA-2p50A:
undetectable
2akeA-2p50A:
21.44
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.
2AVV_A_MK1A901_2
(POL POLYPROTEIN)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 ASP A  25
VAL A  22
PRO A  38
None
0.75A 2avvA-2p50A:
undetectable
2avvA-2p50A:
14.88
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.
2AZX_B_TRPB603_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 THR A  11
GLY A  12
GLY A 350
THR A 336
ILE A   9
None
1.36A 2azxB-2p50A:
undetectable
2azxB-2p50A:
22.79
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.
2HS2_A_017A201_1
(PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.06A 2hs2A-2p50A:
undetectable
2hs2A-2p50A:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ILE A 282
ALA A 274
GLY A  62
GLY A  65
THR A  98
None
1.10A 2okcA-2p50A:
undetectable
2okcA-2p50A:
22.13
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.
2Q5K_A_AB1A201_1
(PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 9 ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.03A 2q5kA-2p50A:
undetectable
2q5kA-2p50A:
16.48
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.
2Q63_A_1UNA1001_1
(PROTEASE RETROPEPSIN)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.17A 2q63A-2p50A:
undetectable
2q63A-2p50A:
17.08
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.
2QD5_A_CHDA702_0
(FERROCHELATASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 LEU A  37
PRO A  38
ARG A  44
None
0.58A 2qd5A-2p50A:
undetectable
2qd5A-2p50A:
23.78
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.
3APX_A_Z80A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 VAL A 380
THR A  93
PHE A  55
ALA A  49
PHE A 363
None
1.49A 3apxA-2p50A:
undetectable
3apxA-2p50A:
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.
3CLD_A_GW6A1_1
(GLUCOCORTICOID
RECEPTOR)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLY A 344
LEU A 349
ARG A 348
CYH A 269
PHE A 213
None
1.48A 3cldA-2p50A:
undetectable
3cldA-2p50A:
21.30
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.
3H52_C_486C4_2
(GLUCOCORTICOID
RECEPTOR)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 MET A   1
CYH A  32
PRO A  38
None
1.03A 3h52C-2p50A:
undetectable
3h52C-2p50A:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JW2_A_017A401_1
(GAG-POL POLYPROTEIN)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.22A 3jw2A-2p50A:
undetectable
3jw2A-2p50A:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JW2_A_017A401_2
(GAG-POL POLYPROTEIN)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.25A 3jw2B-2p50A:
undetectable
3jw2B-2p50A:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K4V_B_ROCB201_1
(HIV-1 PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.27A 3k4vA-2p50A:
undetectable
3k4vA-2p50A:
15.11
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.
3LSF_B_PZIB802_0
(GLUTAMATE RECEPTOR 2)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 SER A 309
ASP A 248
ASN A 319
None
0.92A 3lsfB-2p50A:
undetectable
3lsfE-2p50A:
undetectable
3lsfB-2p50A:
21.14
3lsfE-2p50A:
21.14
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.
3LSF_E_PZIE802_0
(GLUTAMATE RECEPTOR 2)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
3 / 3 ASP A 248
ASN A 319
SER A 309
None
0.88A 3lsfB-2p50A:
undetectable
3lsfE-2p50A:
undetectable
3lsfB-2p50A:
21.14
3lsfE-2p50A:
21.14
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.
3Q07_A_WPPA300_2
(BETA-LACTAMASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 5 CYH A  63
PRO A  97
THR A  79
THR A 312
None
1.40A 3q07A-2p50A:
undetectable
3q07A-2p50A:
21.90
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.
3Q07_B_WPPB400_2
(BETA-LACTAMASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 5 CYH A  63
PRO A  97
THR A  79
THR A 312
None
1.39A 3q07B-2p50A:
undetectable
3q07B-2p50A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TL9_A_ROCA401_1
(PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.22A 3tl9A-2p50A:
undetectable
3tl9A-2p50A:
14.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TM4_B_SAMB401_0
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ALA A 178
GLY A 210
ALA A 214
PRO A 173
LEU A 231
None
1.17A 3tm4B-2p50A:
undetectable
3tm4B-2p50A:
24.11
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.
3WXO_A_NIZA802_1
(CATALASE-PEROXIDASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 8 LEU A 352
ILE A  28
GLY A 376
ILE A 373
None
0.90A 3wxoA-2p50A:
undetectable
3wxoA-2p50A:
21.08
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.
4DF3_A_SAMA301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLY A  62
ALA A 274
THR A 312
PHE A 287
ASP A  70
None
1.46A 4df3A-2p50A:
undetectable
4df3A-2p50A:
21.13
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.
4DF3_B_SAMB301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 GLY A  62
ALA A 274
THR A 312
PHE A 287
ASP A  70
None
1.46A 4df3B-2p50A:
undetectable
4df3B-2p50A:
21.13
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.
4DQF_B_017B101_2
(ASPARTYL PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 10 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.00A 4dqfB-2p50A:
undetectable
4dqfB-2p50A:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JEC_B_478B401_1
(HIV-1 PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
ILE A 189
None
1.15A 4jecA-2p50A:
undetectable
4jecA-2p50A:
14.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q1Y_A_017A106_1
(ASPARTYL PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 10 LEU A 184
ALA A 163
ASP A 164
GLY A 127
VAL A 191
None
0.96A 4q1yA-2p50A:
undetectable
4q1yA-2p50A:
15.38
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.
4ZE0_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 9 ILE A 369
GLY A  54
THR A 336
LEU A 332
LEU A 328
None
1.34A 4ze0A-2p50A:
undetectable
4ze0A-2p50A:
22.04
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.
4ZXI_A_GLYA1402_0
(TYROCIDINE
SYNTHETASE 3)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 7 ASP A 301
ILE A 292
GLY A 308
THR A 305
None
0.97A 4zxiA-2p50A:
undetectable
4zxiA-2p50A:
16.06
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.
5E72_A_SAMA400_0
(N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
6 / 12 PHE A  68
GLY A  64
ILE A  82
THR A  79
PRO A  97
LEU A 128
None
1.41A 5e72A-2p50A:
undetectable
5e72A-2p50A:
25.42
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.
5N0S_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ILE A 181
GLY A 206
ILE A 189
ALA A 185
VAL A 169
None
1.07A 5n0sA-2p50A:
undetectable
5n0sA-2p50A:
22.57
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.
5N0T_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ILE A 181
GLY A 206
ILE A 189
ALA A 185
VAL A 169
None
1.10A 5n0tA-2p50A:
undetectable
5n0tA-2p50A:
22.57
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.
5N0X_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 ILE A 181
GLY A 206
ILE A 189
ALA A 185
VAL A 169
None
1.13A 5n0xA-2p50A:
undetectable
5n0xA-2p50A:
22.57
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 LEU A 126
GLY A  26
ILE A  56
THR A 361
GLY A 376
None
0.90A 5veuH-2p50A:
undetectable
5veuH-2p50A:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XOO_A_ADNA506_1
(GLYCOSAMINOGLYCAN
XYLOSYLKINASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
4 / 6 TYR A   2
LEU A 352
LYS A 371
LEU A  51
None
1.35A 5xooA-2p50A:
undetectable
5xooA-2p50A:
12.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BXN_A_SAMA901_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 LEU A 328
VAL A  21
ARG A   8
ILE A   9
ASP A  17
None
1.45A 6bxnA-2p50A:
undetectable
6bxnA-2p50A:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DGX_A_017A101_1
(PROTEASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 LEU A 184
ALA A 163
GLY A 127
VAL A 191
ILE A 189
None
1.11A 6dgxB-2p50A:
undetectable
6dgxB-2p50A:
12.83
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.
6HCO_A_FY5A1003_0
(ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
2)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 11 THR A 336
PHE A  55
VAL A 317
THR A 372
ILE A 373
None
1.44A 6hcoA-2p50A:
undetectable
6hcoB-2p50A:
1.3
6hcoA-2p50A:
21.43
6hcoB-2p50A:
21.43
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.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 HIS A 216
SER A 192
HIS A 195
HIS A 143
ASP A 273
ZN  A 601 (-3.4A)
None
ZN  A 601 (-3.3A)
None
ZN  A 601 ( 4.5A)
1.20A 6n91A-2p50A:
7.3
6n91A-2p50A:
13.13
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli)
5 / 12 HIS A 216
SER A 192
HIS A 195
HIS A 143
ASP A 273
ZN  A 601 (-3.4A)
None
ZN  A 601 (-3.3A)
None
ZN  A 601 ( 4.5A)
1.21A 6n91B-2p50A:
16.0
6n91B-2p50A:
13.13