SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ija'

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.
1BSX_A_T3A1_1
(PROTEIN (THYROID
HORMONE RECEPTOR
BETA))		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 311
ILE A 313
LEU A 302
ILE A 247
PHE A 318
 None
None
GOL  A 502 (-4.6A)
GOL  A 502 ( 4.4A)
None
 1.18A 1bsxA-4ijaA:
undetectable		 1bsxA-4ijaA:
21.57
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.
1BSX_A_T3A1_1
(PROTEIN (THYROID
HORMONE RECEPTOR
BETA))		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 328
ILE A 295
LEU A 302
ILE A 200
PHE A 251
 None
None
GOL  A 502 (-4.6A)
None
None
 1.16A 1bsxA-4ijaA:
undetectable		 1bsxA-4ijaA:
21.57
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.
1BSX_B_T3B2_1
(PROTEIN (THYROID
HORMONE RECEPTOR
BETA))		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 328
ILE A 295
LEU A 302
ILE A 200
PHE A 251
 None
None
GOL  A 502 (-4.6A)
None
None
 1.16A 1bsxB-4ijaA:
undetectable		 1bsxB-4ijaA:
21.57
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.
1FM6_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 324
ALA A 327
GLN A 331
CYH A 315
LEU A 344
 None
 1.02A 1fm6A-4ijaA:
undetectable		 1fm6A-4ijaA:
22.06
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.
1SG9_A_SAMA301_0
(HEMK PROTEIN)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 166
GLY A 134
ILE A 122
VAL A 175
ASN A 171
 None
 1.23A 1sg9A-4ijaA:
undetectable		 1sg9A-4ijaA:
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.
1VPO_H_TESH1010_1
(ANTI-TESTOSTERONE
(HEAVY CHAIN)
ANTI-TESTOSTERONE
(LIGHT CHAIN))		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 TYR A 196
ALA A 184
TYR A 312
GLY A 211
PRO A 308
 GOL  A 504 (-4.5A)
None
None
K  A 507 ( 4.3A)
None
 1.19A 1vpoH-4ijaA:
undetectable
1vpoL-4ijaA:
undetectable		 1vpoH-4ijaA:
19.02
1vpoL-4ijaA:
19.65
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.
1XZX_X_T3X500_1
(THYROID HORMONE
RECEPTOR BETA-1)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 311
ILE A 313
LEU A 302
ILE A 247
PHE A 318
 None
None
GOL  A 502 (-4.6A)
GOL  A 502 ( 4.4A)
None
 1.16A 1xzxX-4ijaA:
undetectable		 1xzxX-4ijaA:
24.88
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.
2BYO_A_LNLA1217_1
(LIPOPROTEIN LPPX)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 4 VAL A 176
LEU A 104
ILE A 115
LEU A 113
 None
 1.01A 2byoA-4ijaA:
undetectable		 2byoA-4ijaA:
17.63
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.
2NXE_A_SAMA302_1
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		3 / 3 THR A 345
ASP A  79
SER A 136
 None
 0.81A 2nxeA-4ijaA:
undetectable		 2nxeA-4ijaA:
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.
2NXE_B_SAMB303_1
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		3 / 3 THR A 345
ASP A  79
SER A 136
 None
 0.83A 2nxeB-4ijaA:
undetectable		 2nxeB-4ijaA:
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.
2Y7K_D_SALD1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 229
GLY A 209
GLY A 211
LEU A 212
ILE A 200
 GOL  A 502 (-4.0A)
PO4  A 501 (-3.5A)
K  A 507 ( 4.3A)
None
None
 1.13A 2y7kD-4ijaA:
undetectable		 2y7kD-4ijaA:
20.15
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.
3DZU_A_9CRA7223_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 324
ALA A 327
GLN A 331
CYH A 315
LEU A 344
 None
 1.11A 3dzuA-4ijaA:
undetectable		 3dzuA-4ijaA:
23.29
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.
3UVV_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 328
ILE A 295
LEU A 302
ILE A 200
PHE A 251
 None
None
GOL  A 502 (-4.6A)
None
None
 0.94A 3uvvA-4ijaA:
undetectable		 3uvvA-4ijaA:
20.15
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.
4D7B_A_TCWA1126_1
(TRANSTHYRETIN)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 6 LEU A  41
LEU A  38
SER A  35
THR A  33
 None
 1.07A 4d7bB-4ijaA:
undetectable		 4d7bB-4ijaA:
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.
4KM0_A_CP6A201_1
(DIHYDROFOLATE
REDUCTASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 10 ILE A 250
ALA A 255
PHE A 251
LEU A 202
ILE A 247
 None
None
None
None
GOL  A 502 ( 4.4A)
 1.14A 4km0A-4ijaA:
undetectable		 4km0A-4ijaA:
19.90
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.
4KM2_A_TOPA202_1
(DIHYDROFOLATE
REDUCTASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 250
ALA A 255
PHE A 251
LEU A 202
ILE A 247
 None
None
None
None
GOL  A 502 ( 4.4A)
 1.12A 4km2A-4ijaA:
undetectable		 4km2A-4ijaA:
19.90
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.
4M2X_A_TMQA202_1
(DIHYDROFOLATE
REDUCTASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 250
ALA A 255
PHE A 251
LEU A 298
ILE A 247
 None
None
None
GOL  A 502 (-4.3A)
GOL  A 502 ( 4.4A)
 1.02A 4m2xA-4ijaA:
undetectable		 4m2xA-4ijaA:
16.67
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.
4O1E_A_C2FA3000_0
(DIHYDROPTEROATE
SYNTHASE DHPS)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 GLU A 179
ILE A 229
LEU A 302
GLY A 211
SER A 183
 PO4  A 501 (-3.8A)
GOL  A 502 (-4.0A)
GOL  A 502 (-4.6A)
K  A 507 ( 4.3A)
None
 1.17A 4o1eA-4ijaA:
undetectable		 4o1eA-4ijaA:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O1E_B_C2FB4000_0
(DIHYDROPTEROATE
SYNTHASE DHPS)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 GLU A 179
ILE A 229
LEU A 302
GLY A 211
SER A 183
 PO4  A 501 (-3.8A)
GOL  A 502 (-4.0A)
GOL  A 502 (-4.6A)
K  A 507 ( 4.3A)
None
 1.18A 4o1eB-4ijaA:
undetectable		 4o1eB-4ijaA:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BOJ_A_4TXA201_1
(TRANSTHYRETIN)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 6 LEU A  41
LEU A  38
SER A  35
THR A  33
 None
 1.02A 5bojA-4ijaA:
undetectable		 5bojA-4ijaA:
15.61
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.
5KB5_A_ADNA401_2
(ADENOSINE KINASE)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 4 ASN A 181
LEU A 218
SER A 183
LEU A 358
 K  A 507 (-3.0A)
None
None
None
 1.33A 5kb5A-4ijaA:
undetectable		 5kb5A-4ijaA:
23.22
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.
5Z12_C_9CRC501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		5 / 12 ILE A 324
ALA A 327
GLN A 331
CYH A 315
LEU A 344
 None
 1.00A 5z12C-4ijaA:
undetectable		 5z12C-4ijaA:
11.14
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.
6CP4_A_CAMA422_0
(CYTOCHROME P450CAM)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 8 LEU A 113
THR A 170
VAL A 174
VAL A 135
 None
 0.94A 6cp4A-4ijaA:
undetectable		 6cp4A-4ijaA:
19.08
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.
6MN4_A_AM2A301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 8 HIS A  15
ARG A   7
GLU A  11
GLU A  28
 GOL  A 505 (-3.4A)
None
None
None
 1.11A 6mn4A-4ijaA:
undetectable		 6mn4A-4ijaA:
19.44
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.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4ija XYLR PROTEIN
(Staphylococcus
aureus) 		4 / 8 HIS A  15
ARG A   7
GLU A  11
GLU A  28
 GOL  A 505 (-3.4A)
None
None
None
 1.14A 6mn4B-4ijaA:
undetectable		 6mn4B-4ijaA:
19.44