SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4y0x'

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.
1ERR_B_RALB600_1
(ESTROGEN RECEPTOR)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 12 THR A 330
LEU A 335
ILE A 210
LEU A 264
LEU A 369
 None
 1.16A 1errB-4y0xA:
undetectable		 1errB-4y0xA:
21.15
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.
1ERR_B_RALB600_1
(ESTROGEN RECEPTOR)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 12 THR A 330
LEU A 335
ILE A 210
LEU A 264
LEU A 392
 None
 1.06A 1errB-4y0xA:
undetectable		 1errB-4y0xA:
21.15
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.
1H4O_C_BEZC1162_0
(PEROXIREDOXIN 5)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 9 THR A 309
PRO A 310
GLY A 311
THR A 344
GLY A 347
 None
 1.25A 1h4oC-4y0xA:
undetectable
1h4oD-4y0xA:
undetectable		 1h4oC-4y0xA:
17.60
1h4oD-4y0xA:
17.60
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.
1LIK_A_ADNA799_1
(ADENOSINE KINASE)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 10 THR A 323
GLY A 321
VAL A 273
ALA A 314
GLN A 313
 None
 1.05A 1likA-4y0xA:
undetectable		 1likA-4y0xA:
22.69
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.
2FUM_B_MIXB1539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		7 / 12 MET A 232
TYR A 234
VAL A 235
LYS A 278
ASN A 281
MET A 283
ASP A 293
 ADP  A 501 (-3.3A)
ADP  A 501 (-4.4A)
ADP  A 501 (-3.8A)
MG  A 503 ( 4.8A)
MG  A 503 ( 2.9A)
ADP  A 501 ( 4.3A)
MG  A 504 (-2.3A)
 0.75A 2fumB-4y0xA:
22.9		 2fumB-4y0xA:
28.26
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.
2Q6O_B_SAMB500_0
(HYPOTHETICAL PROTEIN)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 6 ASP A 403
VAL A 399
PRO A 249
THR A 339
 None
 1.24A 2q6oB-4y0xA:
undetectable		 2q6oB-4y0xA:
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.
2XF3_A_J01A500_1
(ORF12)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 10 VAL A 395
ILE A 254
LEU A 353
LEU A 335
GLY A 332
 None
 1.27A 2xf3A-4y0xA:
undetectable		 2xf3A-4y0xA:
20.56
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.
3WAR_A_NIOA401_1
(CASEIN KINASE II
SUBUNIT ALPHA)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 179
LYS A 181
ILE A 292
ASP A 293
 ADP  A 501 (-4.7A)
ADP  A 501 (-2.7A)
ADP  A 501 ( 4.2A)
MG  A 504 (-2.3A)
 0.72A 3warA-4y0xA:
14.5		 3warA-4y0xA:
23.19
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		6 / 12 ILE A 230
MET A 232
ASP A 276
LYS A 278
ASN A 281
GLY A 308
 None
ADP  A 501 (-3.3A)
None
MG  A 503 ( 4.8A)
MG  A 503 ( 2.9A)
None
 1.20A 4an2A-4y0xA:
15.3		 4an2A-4y0xA:
22.09
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		6 / 12 LYS A 181
ILE A 230
MET A 232
ASP A 276
LYS A 278
ASN A 281
 ADP  A 501 (-2.7A)
None
ADP  A 501 (-3.3A)
None
MG  A 503 ( 4.8A)
MG  A 503 ( 2.9A)
 0.86A 4an2A-4y0xA:
15.3		 4an2A-4y0xA:
22.09
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		6 / 12 LYS A 181
LEU A 202
ILE A 230
LYS A 278
ASN A 281
ASP A 293
 ADP  A 501 (-2.7A)
None
None
MG  A 503 ( 4.8A)
MG  A 503 ( 2.9A)
MG  A 504 (-2.3A)
 1.18A 4an2A-4y0xA:
15.3		 4an2A-4y0xA:
22.09
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.
4AN2_A_EUIA1382_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		6 / 12 LYS A 181
LEU A 202
ILE A 230
MET A 232
LYS A 278
ASN A 281
 ADP  A 501 (-2.7A)
None
None
ADP  A 501 (-3.3A)
MG  A 503 ( 4.8A)
MG  A 503 ( 2.9A)
 0.98A 4an2A-4y0xA:
15.3		 4an2A-4y0xA:
22.09
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.
4LMN_A_EUIA503_1
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 12 LYS A 181
LEU A 202
ILE A 230
MET A 232
ASN A 281
 ADP  A 501 (-2.7A)
None
None
ADP  A 501 (-3.3A)
MG  A 503 ( 2.9A)
 0.92A 4lmnA-4y0xA:
18.7		 4lmnA-4y0xA:
20.97
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.
4XJE_A_TOYA202_1
(AADB)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 8 ASP A 293
ASP A 276
TYR A 305
ILE A 317
 MG  A 504 (-2.3A)
None
None
None
 0.89A 4xjeA-4y0xA:
undetectable		 4xjeA-4y0xA:
18.55
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.
4Z91_F_4LEF401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 7 THR A 334
LEU A 335
THR A 330
LEU A 261
 None
 0.90A 4z91F-4y0xA:
undetectable
4z91G-4y0xA:
undetectable
4z91H-4y0xA:
undetectable
4z91I-4y0xA:
undetectable
4z91J-4y0xA:
undetectable		 4z91F-4y0xA:
20.99
4z91G-4y0xA:
20.99
4z91H-4y0xA:
20.99
4z91I-4y0xA:
20.99
4z91J-4y0xA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CFS_A_TOYA203_1
(AAD(2''),GENTAMICIN
2''-NUCLEOTIDYLTRANS
FERASE,GENTAMICIN
RESISTANCE PROTEIN)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 8 ASP A 293
ASP A 276
TYR A 305
ILE A 317
 MG  A 504 (-2.3A)
None
None
None
 0.97A 5cfsA-4y0xA:
undetectable		 5cfsA-4y0xA:
18.55
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.
5X23_A_LSNA502_1
(CYTOCHROME P450 2C9)		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 217
GLY A 149
ALA A 148
LEU A 141
LEU A 180
 None
 1.37A 5x23A-4y0xA:
undetectable		 5x23A-4y0xA:
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.
5Y9M_X_NIOX401_1
(CASEIN KINASE II
SUBUNIT ALPHA')		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 179
LYS A 181
ILE A 292
ASP A 293
 ADP  A 501 (-4.7A)
ADP  A 501 (-2.7A)
ADP  A 501 ( 4.2A)
MG  A 504 (-2.3A)
 0.66A 5y9mX-4y0xA:
14.8		 5y9mX-4y0xA:
11.78
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.
5YF9_B_NIOB401_1
(CASEIN KINASE II
SUBUNIT ALPHA')		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 7 VAL A 179
LYS A 181
ILE A 292
ASP A 293
 ADP  A 501 (-4.7A)
ADP  A 501 (-2.7A)
ADP  A 501 ( 4.2A)
MG  A 504 (-2.3A)
 0.69A 5yf9B-4y0xA:
17.7		 5yf9B-4y0xA:
11.78
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.
5YWM_X_NIOX403_0
(CASEIN KINASE II
SUBUNIT ALPHA')		 4y0x SERINE/THREONINE-PRO
TEIN KINASE PKNG
(Mycobacterium
tuberculosis) 		4 / 7 VAL A 179
LYS A 181
ILE A 292
ASP A 293
 ADP  A 501 (-4.7A)
ADP  A 501 (-2.7A)
ADP  A 501 ( 4.2A)
MG  A 504 (-2.3A)
 0.80A 5ywmX-4y0xA:
15.1		 5ywmX-4y0xA:
11.78