SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4dq8'

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.
1JTV_A_TESA500_1
(17
BETA-HYDROXYSTEROID
DEHYDROGENASE TYPE 1)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 8 VAL A  58
LEU A  20
HIS A  79
VAL A  77
 None
 0.84A 1jtvA-4dq8A:
undetectable		 1jtvA-4dq8A:
25.26
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.
2M2O_B_DHIB24_0
(INSULIN B CHAIN)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 6 ARG A 328
GLY A 321
PRO A 370
THR A 371
 None
 1.26A 2m2oB-4dq8A:
undetectable		 2m2oB-4dq8A:
5.69
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.
3IA4_D_MTXD164_2
(DIHYDROFOLATE
REDUCTASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		3 / 3 ARG A 270
ILE A 320
THR A 371
 None
 0.69A 3ia4D-4dq8A:
undetectable		 3ia4D-4dq8A:
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.
3RUK_D_AERD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 11 ALA A 202
GLY A 319
ALA A 318
THR A 371
VAL A 176
 None
 1.21A 3rukD-4dq8A:
undetectable		 3rukD-4dq8A:
22.82
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.
3VAS_B_ADNB401_1
(PUTATIVE ADENOSINE
KINASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 LEU A 196
GLY A 232
GLY A 224
LEU A 297
GLY A 218
 None
 1.06A 3vasB-4dq8A:
undetectable		 3vasB-4dq8A:
22.22
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.
4FE1_A_PQNA846_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 10 ALA A 208
LEU A 308
GLY A 309
ALA A 202
MET A 227
 None
 1.23A 4fe1A-4dq8A:
undetectable
4fe1J-4dq8A:
undetectable		 4fe1A-4dq8A:
18.53
4fe1J-4dq8A:
7.47
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.
4FEU_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 7 ASP A 324
ASP A 330
ASP A 280
GLU A 344
 None
 1.19A 4feuB-4dq8A:
undetectable		 4feuB-4dq8A:
22.14
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.
4FEU_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 8 ASP A 324
ASP A 330
ASP A 280
GLU A 344
 None
 1.17A 4feuF-4dq8A:
undetectable		 4feuF-4dq8A:
22.14
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.
4FEX_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 7 ASP A 324
ASP A 330
ASP A 280
GLU A 344
 None
 1.22A 4fexB-4dq8A:
undetectable		 4fexB-4dq8A:
22.14
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.
4FN9_B_STRB301_1
(STEROID RECEPTOR 2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 LEU A 102
LEU A 105
ASN A 113
LEU A 108
ALA A 109
 None
 1.22A 4fn9B-4dq8A:
undetectable		 4fn9B-4dq8A:
21.21
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.
4GC9_A_ACTA402_0
(DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		3 / 3 LYS A 299
TYR A 300
ARG A 296
 None
 1.41A 4gc9A-4dq8A:
undetectable		 4gc9A-4dq8A:
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.
4GKI_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 8 ASP A 324
ASP A 330
ASP A 280
GLU A 344
 None
 1.14A 4gkiC-4dq8A:
undetectable		 4gkiC-4dq8A:
22.14
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.
4JTQ_A_FLPA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 10 VAL A  77
HIS A  79
VAL A 130
LEU A  20
LEU A  55
 None
 1.43A 4jtqA-4dq8A:
undetectable		 4jtqA-4dq8A:
21.31
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.
4KCN_A_MTLA804_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 6 ARG A 345
ARG A 356
ASP A 343
ASP A 360
 None
 1.37A 4kcnA-4dq8A:
undetectable		 4kcnA-4dq8A:
22.44
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.
4KCN_B_MTLB805_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 6 ARG A 345
ARG A 356
ASP A 343
ASP A 360
 None
 1.38A 4kcnB-4dq8A:
undetectable		 4kcnB-4dq8A:
22.44
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.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 6 PHE A 293
ASP A 324
LEU A 198
THR A 331
 None
 1.30A 4paeA-4dq8A:
undetectable		 4paeA-4dq8A:
21.29
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 GLU A 214
GLU A 223
LEU A 144
GLY A 167
GLY A 218
 None
 1.03A 5e3iA-4dq8A:
undetectable		 5e3iA-4dq8A:
22.95
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.
5JHN_A_SAMA1205_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 MET A 217
GLY A 218
TYR A 304
HIS A 197
PHE A 141
 None
 1.43A 5jhnA-4dq8A:
undetectable		 5jhnA-4dq8A:
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.
5JLC_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		4 / 5 GLY A 170
THR A 171
GLY A 339
LEU A 196
 None
 0.93A 5jlcA-4dq8A:
undetectable		 5jlcA-4dq8A:
19.89
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.
5T0M_B_SAMB1205_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 MET A 217
GLY A 218
TYR A 304
HIS A 197
PHE A 141
 None
 1.40A 5t0mB-4dq8A:
undetectable		 5t0mB-4dq8A:
17.48
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.
5VSC_B_SAMB1505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 MET A 217
GLY A 218
TYR A 304
HIS A 197
PHE A 141
 None
 1.42A 5vscB-4dq8A:
undetectable		 5vscB-4dq8A:
18.94
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.
5VSE_A_SAMA1505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 MET A 217
GLY A 218
TYR A 304
HIS A 197
PHE A 141
 None
 1.41A 5vseA-4dq8A:
undetectable		 5vseA-4dq8A:
18.94
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.
5VSE_B_SAMB1505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 4dq8 ACETATE KINASE
(Mycobacterium
marinum) 		5 / 12 MET A 217
GLY A 218
TYR A 304
HIS A 197
PHE A 141
 None
 1.41A 5vseB-4dq8A:
undetectable		 5vseB-4dq8A:
18.94