SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3a3u'

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.
1GSE_A_EAAA224_1
(GLUTATHIONE
TRANSFERASE)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 GLY A  75
LEU A  77
VAL A 250
ALA A  70
PHE A 271
 None
 1.06A 1gseA-3a3uA:
undetectable		 1gseA-3a3uA:
21.94
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.
1UKB_A_BEZA1300_0
(2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 11 GLY A  89
ALA A  87
ALA A 140
LEU A  97
VAL A  85
 None
 1.14A 1ukbA-3a3uA:
undetectable		 1ukbA-3a3uA:
23.61
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.
2AYL_A_FLPA1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 VAL A 250
LEU A 253
LEU A 270
GLY A 177
ALA A 178
 None
None
None
TLA  A 401 ( 4.4A)
None
 1.01A 2aylA-3a3uA:
undetectable		 2aylA-3a3uA:
19.46
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.
2AYL_B_FLPB2701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 VAL A 250
LEU A 253
LEU A 270
GLY A 177
ALA A 178
 None
None
None
TLA  A 401 ( 4.4A)
None
 1.01A 2aylB-3a3uA:
undetectable		 2aylB-3a3uA:
19.46
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.
2BFP_A_H4BA1290_1
(PTERIDINE REDUCTASE
1)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 8 SER A  73
LEU A  32
LEU A 189
LEU A 185
 None
 0.98A 2bfpA-3a3uA:
undetectable		 2bfpA-3a3uA:
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.
2BFP_B_H4BB1290_1
(PTERIDINE REDUCTASE
1)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 8 SER A  73
LEU A  32
LEU A 189
LEU A 185
 None
 0.95A 2bfpB-3a3uA:
undetectable		 2bfpB-3a3uA:
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.
2J9D_A_ACTA1117_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		3 / 3 ASP A  66
ARG A  67
ARG A 183
 None
 1.03A 2j9dA-3a3uA:
undetectable
2j9dC-3a3uA:
undetectable		 2j9dA-3a3uA:
20.00
2j9dC-3a3uA:
20.00
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.
3KK6_A_CELA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 VAL A 250
LEU A 253
LEU A 270
GLY A 177
ALA A 178
 None
None
None
TLA  A 401 ( 4.4A)
None
 1.04A 3kk6A-3a3uA:
undetectable		 3kk6A-3a3uA:
19.46
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.
3M6V_A_SAMA465_0
(RRNA METHYLASE)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 GLY A  74
GLY A  75
VAL A  22
PRO A  34
LEU A  36
 None
 1.08A 3m6vA-3a3uA:
undetectable		 3m6vA-3a3uA:
24.26
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.
3M6W_A_SAMA465_0
(RRNA METHYLASE)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 GLY A  74
GLY A  75
VAL A  22
PRO A  34
LEU A  36
 None
 1.04A 3m6wA-3a3uA:
undetectable		 3m6wA-3a3uA:
24.26
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.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 6 PHE A 254
THR A 107
ALA A 263
ALA A 257
 None
TLA  A 401 (-3.9A)
None
None
 1.06A 3ns1C-3a3uA:
undetectable		 3ns1C-3a3uA:
17.93
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.
3P5N_A_RBFA190_1
(RIBOFLAVIN UPTAKE
PROTEIN)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 ASP A 161
GLY A  82
ALA A  76
LEU A  84
ASN A  13
 None
None
TLA  A 401 ( 4.8A)
None
None
 1.17A 3p5nA-3a3uA:
undetectable		 3p5nA-3a3uA:
21.82
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.
4OAE_A_CLMA207_0
(GNAT SUPERFAMILY
ACETYLTRANSFERASE
PA4794)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 GLU A 137
ALA A 134
ARG A 128
ALA A 100
GLY A 141
 None
 1.00A 4oaeA-3a3uA:
undetectable		 4oaeA-3a3uA:
21.98
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.
4WQ4_B_ACTB403_0
(TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		3 / 3 ARG A 183
ASP A 184
ARG A 182
 None
 0.69A 4wq4B-3a3uA:
undetectable		 4wq4B-3a3uA:
27.35
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)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 7 PHE A  18
ASP A  14
ILE A  17
GLY A  74
 None
 1.09A 4zxiA-3a3uA:
undetectable		 4zxiA-3a3uA:
12.27
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 5 VAL A 250
VAL A 242
GLY A 243
PHE A 271
 None
 0.60A 5d4nA-3a3uA:
undetectable
5d4nC-3a3uA:
undetectable		 5d4nA-3a3uA:
16.91
5d4nC-3a3uA:
16.91
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.
5VLM_B_CVIB301_0
(REGULATORY PROTEIN
TETR)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		5 / 12 GLN A  63
ALA A  62
LEU A  56
VAL A 250
PHE A 271
 None
 1.19A 5vlmB-3a3uA:
undetectable		 5vlmB-3a3uA:
23.38
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.
5X2T_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 3a3u MENAQUINONE
BIOSYNTHETIC ENZYME
(Thermus
thermophilus) 		4 / 8 PRO A 175
ALA A  70
ALA A 257
TRP A 166
 None
 1.01A 5x2tI-3a3uA:
undetectable
5x2tJ-3a3uA:
undetectable
5x2tK-3a3uA:
undetectable
5x2tL-3a3uA:
undetectable		 5x2tI-3a3uA:
22.06
5x2tJ-3a3uA:
24.26
5x2tK-3a3uA:
22.06
5x2tL-3a3uA:
24.26