SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2hae'

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.
1NW3_A_SAMA500_0
(HISTONE
METHYLTRANSFERASE
DOT1L)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 GLU A 351
ALA A 345
LEU A 199
PHE A 299
PHE A 279
None
1.34A 1nw3A-2haeA:
4.7
1nw3A-2haeA:
22.96
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.
1S1U_A_NVPA999_1
(REVERSE
TRANSCRIPTASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 10 ILE A 332
VAL A 372
VAL A 326
GLY A 324
LEU A 337
None
1.34A 1s1uA-2haeA:
undetectable
1s1uA-2haeA:
21.50
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
4 / 8 PHE A 318
GLY A 158
VAL A 161
LEU A 337
None
0.79A 3bgdB-2haeA:
5.4
3bgdB-2haeA:
22.08
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.
3HGX_A_SALA102_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
4 / 7 VAL A 301
MET A 272
ILE A 269
ILE A 288
None
0.98A 3hgxA-2haeA:
undetectable
3hgxA-2haeA:
13.73
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.
3K13_A_THHA642_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 ASN A 127
ASP A 154
VAL A 162
GLY A 320
ILE A 321
None
1.20A 3k13A-2haeA:
undetectable
3k13A-2haeA:
25.55
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.
3K13_B_THHB643_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 ASN A 127
ASP A 154
VAL A 162
GLY A 320
ILE A 321
None
1.20A 3k13B-2haeA:
undetectable
3k13B-2haeA:
25.55
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.
3K13_C_THHC643_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 ASN A 127
ASP A 154
VAL A 162
GLY A 320
ILE A 321
None
1.20A 3k13C-2haeA:
undetectable
3k13C-2haeA:
25.55
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.
3OCT_A_1N1A663_2
(TYROSINE-PROTEIN
KINASE BTK)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
4 / 5 PHE A 255
ILE A 300
ASN A 262
PHE A 254
None
1.34A 3octA-2haeA:
undetectable
3octA-2haeA:
21.87
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.
4FXS_A_MOAA702_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 9 ASN A 217
ILE A 215
GLY A 243
THR A 247
ASP A 220
None
1.27A 4fxsA-2haeA:
undetectable
4fxsA-2haeA:
25.92
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.
4HYF_B_NCAB1201_0
(TANKYRASE-2)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
4 / 8 GLY A 192
TYR A 228
LYS A 197
GLU A 231
None
0.89A 4hyfB-2haeA:
undetectable
4hyfB-2haeA:
21.77
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.
4J7X_F_SASF805_1
(SEPIAPTERIN
REDUCTASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 SER A 144
LEU A 143
ASP A 155
ASP A 130
GLY A 132
None
1.32A 4j7xF-2haeA:
2.5
4j7xF-2haeA:
21.87
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.
5E4D_B_BEZB203_0
(HYDROXYNITRILE LYASE)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
4 / 4 VAL A 372
ALA A 376
ILE A 332
THR A 333
None
1.02A 5e4dB-2haeA:
undetectable
5e4dB-2haeA:
18.48
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.
5HI2_A_BAXA801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 8 VAL A 204
VAL A 312
ILE A 355
ILE A 300
PHE A 254
None
1.32A 5hi2A-2haeA:
undetectable
5hi2A-2haeA:
20.21
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.
5KBW_B_RBFB201_1
(RIBOFLAVIN
TRANSPORTER RIBU)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 GLU A 287
GLY A 304
ASN A 283
ASN A 314
VAL A 162
None
1.38A 5kbwB-2haeA:
undetectable
5kbwB-2haeA:
19.31
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.
5LF7_K_6V8K305_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 11 ALA A 248
THR A 247
VAL A 208
GLY A 251
ALA A 252
None
0.80A 5lf7K-2haeA:
undetectable
5lf7L-2haeA:
undetectable
5lf7K-2haeA:
22.22
5lf7L-2haeA:
20.94
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.
5LF7_Y_6V8Y306_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 11 ALA A 248
THR A 247
VAL A 208
GLY A 251
ALA A 252
None
0.81A 5lf7Y-2haeA:
undetectable
5lf7Z-2haeA:
undetectable
5lf7Y-2haeA:
22.22
5lf7Z-2haeA:
20.94
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.
6A94_B_ZOTB3001_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 2A,SOLUBLE
CYTOCHROME B562)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 VAL A 163
LEU A 199
VAL A 196
GLY A 192
PHE A 152
None
1.15A 6a94B-2haeA:
undetectable
6a94B-2haeA:
22.57
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.
6A94_B_ZOTB3001_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 2A,SOLUBLE
CYTOCHROME B562)
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima)
5 / 12 VAL A 163
THR A 159
LEU A 199
GLY A 192
PHE A 152
None
1.14A 6a94B-2haeA:
undetectable
6a94B-2haeA:
22.57