SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4kqk'

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.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 8 GLY A 264
GLY A 173
MET A 246
LEU A 243
ASP A 242
None
1.34A 1aegA-4kqkA:
undetectable
1aegA-4kqkA:
21.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1D0V_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
7 / 8 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
0.42A 1d0vA-4kqkA:
62.7
1d0vA-4kqkA:
98.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1D0V_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
7 / 8 THR A 180
GLY A 202
GLY A 264
PHE A 265
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
0.41A 1d0vA-4kqkA:
62.7
1d0vA-4kqkA:
98.60
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.
1ICU_A_NIOA221_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 SER A 193
THR A 191
PHE A 265
GLU A 197
None
1.06A 1icuA-4kqkA:
undetectable
1icuB-4kqkA:
undetectable
1icuA-4kqkA:
22.84
1icuB-4kqkA:
22.84
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.
1ICU_B_NIOB219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 PHE A 265
GLU A 197
SER A 193
THR A 191
None
1.04A 1icuA-4kqkA:
undetectable
1icuB-4kqkA:
undetectable
1icuA-4kqkA:
22.84
1icuB-4kqkA:
22.84
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.
1ICU_C_NIOC225_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 SER A 193
THR A 191
PHE A 265
GLU A 197
None
1.09A 1icuC-4kqkA:
undetectable
1icuD-4kqkA:
undetectable
1icuC-4kqkA:
22.84
1icuD-4kqkA:
22.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JHA_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
7 / 8 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
0.42A 1jhaA-4kqkA:
62.9
1jhaA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JHA_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
7 / 8 THR A 180
GLY A 202
GLY A 264
PHE A 265
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
0.39A 1jhaA-4kqkA:
62.9
1jhaA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JHO_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.55A 1jhoA-4kqkA:
62.9
1jhoA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JHR_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.53A 1jhrA-4kqkA:
62.7
1jhrA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JHY_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.54A 1jhyA-4kqkA:
62.9
1jhyA-4kqkA:
98.88
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.
1KQB_A_BEZA524_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 SER A 193
THR A 191
PHE A 265
GLU A 197
None
1.12A 1kqbA-4kqkA:
undetectable
1kqbB-4kqkA:
undetectable
1kqbA-4kqkA:
23.60
1kqbB-4kqkA:
23.60
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.
1KQB_C_BEZC522_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 SER A 193
THR A 191
PHE A 265
GLU A 197
None
1.13A 1kqbC-4kqkA:
undetectable
1kqbD-4kqkA:
undetectable
1kqbC-4kqkA:
23.60
1kqbD-4kqkA:
23.60
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.
1KQB_D_BEZD523_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 PHE A 265
GLU A 197
SER A 193
THR A 191
None
1.15A 1kqbC-4kqkA:
undetectable
1kqbD-4kqkA:
undetectable
1kqbC-4kqkA:
23.60
1kqbD-4kqkA:
23.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.57A 1l4nA-4kqkA:
63.0
1l4nA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.56A 1l5kA-4kqkA:
62.6
1l5kA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.57A 1l5lA-4kqkA:
63.1
1l5lA-4kqkA:
98.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.58A 1l5mA-4kqkA:
52.5
1l5mA-4kqkA:
98.88
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.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 11 ALA A 254
VAL A 281
VAL A 172
LEU A 235
ALA A 270
None
1.06A 1n4hA-4kqkA:
undetectable
1n4hA-4kqkA:
20.61
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.
1XZ1_A_HLTA2001_1
(FERRITIN LIGHT CHAIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 4 LEU A 272
SER A 269
TYR A 268
LEU A 303
None
1.22A 1xz1A-4kqkA:
undetectable
1xz1A-4kqkA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XZ3_A_ICFA201_1
(FERRITIN LIGHT CHAIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 4 LEU A 272
SER A 269
TYR A 268
LEU A 303
None
1.22A 1xz3A-4kqkA:
undetectable
1xz3A-4kqkA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A1O_A_CAMA1422_0
(CYTOCHROME P450-CAM)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 8 THR A 159
LEU A  64
VAL A 172
GLY A 171
None
0.91A 2a1oA-4kqkA:
undetectable
2a1oA-4kqkA:
24.18
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.
2BR4_E_SAME301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
3 / 3 SER A 269
ASP A 242
CYH A 134
None
0.92A 2br4E-4kqkA:
undetectable
2br4E-4kqkA:
19.68
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.
2CEO_B_T44B1395_1
(THYROXINE-BINDING
GLOBULIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 10 ALA A 278
LEU A 153
LEU A   8
ARG A 157
ARG A 255
None
1.21A 2ceoB-4kqkA:
undetectable
2ceoB-4kqkA:
18.87
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.
2RK8_A_PPFA3969_1
(PHOSPHOENOLPYRUVATE
CARBOXYKINASE,
CYTOSOLIC [GTP])
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 8 HIS A 289
SER A 291
ASP A 263
ALA A 296
None
1.40A 2rk8A-4kqkA:
undetectable
2rk8A-4kqkA:
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.
2VH3_B_DAHB2_1
(RANASMURFIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 8 ALA A 183
GLY A 245
SER A 269
ALA A 270
None
0.77A 2vh3B-4kqkA:
undetectable
2vh3B-4kqkA:
15.53
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.
2XFS_B_J01B600_1
(ORF12)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 11 ALA A 321
SER A 288
TYR A 268
GLY A 318
SER A 319
None
1.22A 2xfsB-4kqkA:
undetectable
2xfsB-4kqkA:
23.87
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.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 GLY A  71
GLY A 135
ALA A 131
ALA A 138
VAL A 139
None
1.09A 2yvlB-4kqkA:
undetectable
2yvlB-4kqkA:
20.75
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.
3FUU_A_ADNA0_1
(DIMETHYLADENOSINE
TRANSFERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 VAL A 238
GLY A 231
ALA A 185
PRO A 226
ILE A 221
None
0.93A 3fuuA-4kqkA:
undetectable
3fuuA-4kqkA:
23.81
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.
3MDT_B_VORB506_1
(CHOLESTEROL
24-HYDROXYLASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 11 LEU A 251
VAL A 155
SER A 156
ILE A 277
ALA A 273
None
0.92A 3mdtB-4kqkA:
undetectable
3mdtB-4kqkA:
22.38
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.
3PP1_A_ACTA590_0
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 5 GLU A 174
LEU A 243
HIS A  70
GLY A 240
None
1.15A 3pp1A-4kqkA:
undetectable
3pp1A-4kqkA:
23.10
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.
3RD0_A_EDPA175_1
(FERRITIN LIGHT CHAIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 LEU A 272
TYR A 268
ALA A 183
LEU A 303
None
1.11A 3rd0A-4kqkA:
undetectable
3rd0A-4kqkA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RD0_A_EDPA175_1
(FERRITIN LIGHT CHAIN)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 6 SER A 269
TYR A 268
ALA A 183
LEU A 303
None
1.11A 3rd0A-4kqkA:
undetectable
3rd0A-4kqkA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 GLY A 166
VAL A 167
THR A 168
LEU A 258
GLN A  57
None
1.17A 4f84A-4kqkA:
undetectable
4f84A-4kqkA:
23.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KMU_H_RFPH1401_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 GLN A  45
ASP A 263
LEU A  42
ARG A  38
ILE A 327
None
None
None
SO4  A 401 (-3.9A)
EDO  A 406 (-4.8A)
1.34A 4kmuH-4kqkA:
undetectable
4kmuH-4kqkA:
13.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KQI_A_NIOA403_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
8 / 9 THR A 180
GLY A 202
GLY A 264
PHE A 265
LEU A 266
SER A 291
ARG A 314
GLY A 316
SO4  A 402 (-2.9A)
SO4  A 402 (-3.6A)
None
None
None
None
None
None
0.56A 4kqiA-4kqkA:
63.5
4kqiA-4kqkA:
98.88
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.
4KYK_B_IMNB300_1
(LACTOYLGLUTATHIONE
LYASE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 ALA A 183
MET A 186
LEU A 303
GLY A 245
MET A 246
None
1.27A 4kykA-4kqkA:
undetectable
4kykB-4kqkA:
undetectable
4kykA-4kqkA:
16.71
4kykB-4kqkA:
16.71
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.
4P6X_I_HCYI900_1
(GLUCOCORTICOID
RECEPTOR)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 LEU A 169
GLY A  59
LEU A  46
MET A  49
THR A 159
None
1.46A 4p6xI-4kqkA:
undetectable
4p6xI-4kqkA:
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.
4PFJ_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 THR A 247
ASP A 230
LEU A   4
LEU A 152
PHE A 190
None
1.29A 4pfjB-4kqkA:
2.8
4pfjB-4kqkA:
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.
5IGJ_A_CTYA402_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 ILE A 137
GLU A 149
ALA A 274
ALA A 273
GLY A 248
None
0.99A 5igjA-4kqkA:
undetectable
5igjA-4kqkA:
24.41
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.
5IGP_A_ERYA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 ILE A 137
GLU A 149
ALA A 274
ALA A 273
GLY A 248
None
0.97A 5igpA-4kqkA:
undetectable
5igpA-4kqkA:
24.41
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.
5IGT_A_ERYA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
5 / 12 ILE A 137
GLU A 149
ALA A 274
ALA A 273
GLY A 248
None
0.99A 5igtA-4kqkA:
undetectable
5igtA-4kqkA:
24.41
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.
5IKR_A_ID8A601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
3 / 3 VAL A  58
LEU A  29
MET A 338
None
0.90A 5ikrA-4kqkA:
undetectable
5ikrA-4kqkA:
19.85
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.
6CDU_F_EY4F500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Salmonella
enterica)
4 / 7 ALA A 183
THR A 180
ILE A 298
VAL A 187
None
SO4  A 402 (-2.9A)
None
None
0.95A 6cduF-4kqkA:
undetectable
6cduJ-4kqkA:
undetectable
6cduF-4kqkA:
22.04
6cduJ-4kqkA:
22.04