SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'HPX'


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.
1D4F_C_ADNC603_1
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 HIS A 249
THR A 252
LEU A 303
HIS A 217
PHE A 270
HPX  A 406 (-3.4A)
HPX  A 406 ( 3.8A)
None
FE  A 400 ( 3.4A)
None
1.46A 1d4fC-3lm4A:
undetectable
1d4fC-3lm4A:
21.00
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.
1NKI_A_PPFA5001_1
(PROBABLE FOSFOMYCIN
RESISTANCE PROTEIN)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 9 HIS A 217
SER A 254
TYR A 258
GLU A 268
HIS A 155
FE  A 400 ( 3.4A)
HPX  A 406 ( 4.5A)
None
FE  A 400 (-2.7A)
FE  A 400 ( 3.5A)
1.23A 1nkiA-3lm4A:
8.6
1nkiB-3lm4A:
8.5
1nkiA-3lm4A:
18.15
1nkiB-3lm4A:
18.15
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.
1NKI_B_PPFB5002_1
(PROBABLE FOSFOMYCIN
RESISTANCE PROTEIN)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 9 HIS A 155
HIS A 217
SER A 254
TYR A 258
GLU A 268
FE  A 400 ( 3.5A)
FE  A 400 ( 3.4A)
HPX  A 406 ( 4.5A)
None
FE  A 400 (-2.7A)
1.24A 1nkiA-3lm4A:
8.6
1nkiB-3lm4A:
8.5
1nkiA-3lm4A:
18.15
1nkiB-3lm4A:
18.15
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.
2XCT_X_CPFX1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
4 / 4 ARG A 181
GLY A 190
GLU A 188
SER A 254
None
None
None
HPX  A 406 ( 4.5A)
1.24A 2xctS-3lm4A:
undetectable
2xctU-3lm4A:
undetectable
2xctS-3lm4A:
20.43
2xctU-3lm4A:
20.43
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.
2YLG_A_ASCA130_0
(CYTOCHROME C')
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
4 / 5 ALA A 244
GLY A 299
LYS A 248
HIS A 249
None
None
None
HPX  A 406 (-3.4A)
1.42A 2ylgA-3lm4A:
undetectable
2ylgA-3lm4A:
15.03
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.
2ZWE_B_DAHB98_1
(TYROSINASE
MELC)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.24A 2zweA-3lm4A:
undetectable
2zweB-3lm4A:
undetectable
2zweA-3lm4A:
22.54
2zweB-3lm4A:
18.88
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.
2ZWF_B_DAHB98_1
(TYROSINASE
MELC)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.23A 2zwfA-3lm4A:
undetectable
2zwfB-3lm4A:
undetectable
2zwfA-3lm4A:
22.54
2zwfB-3lm4A:
18.88
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.
2ZWG_B_DAHB98_1
(TYROSINASE
MELC)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.24A 2zwgA-3lm4A:
undetectable
2zwgB-3lm4A:
undetectable
2zwgA-3lm4A:
22.54
2zwgB-3lm4A:
18.88
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.
4O8F_B_BRLB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 HIS A 155
VAL A 182
MET A 289
MET A 205
HIS A 217
FE  A 400 ( 3.5A)
None
HPX  A 406 ( 4.6A)
HPX  A 406 (-3.5A)
FE  A 400 ( 3.4A)
1.45A 4o8fB-3lm4A:
undetectable
4o8fB-3lm4A:
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.
4O8F_B_BRLB501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 SER A 254
HIS A 155
VAL A 182
MET A 289
HIS A 217
HPX  A 406 ( 4.5A)
FE  A 400 ( 3.5A)
None
HPX  A 406 ( 4.6A)
FE  A 400 ( 3.4A)
1.41A 4o8fB-3lm4A:
undetectable
4o8fB-3lm4A:
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.
4PFJ_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 HIS A 249
THR A 252
LEU A 303
HIS A 217
PHE A 270
HPX  A 406 (-3.4A)
HPX  A 406 ( 3.8A)
None
FE  A 400 ( 3.4A)
None
1.42A 4pfjB-3lm4A:
undetectable
4pfjB-3lm4A:
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.
4RVG_A_SAMA503_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 THR A 178
ILE A 189
GLY A 190
VAL A 182
ILE A 292
None
HPX  A 406 (-4.1A)
None
None
None
1.00A 4rvgA-3lm4A:
undetectable
4rvgA-3lm4A:
24.12
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.
5JLI_A_ASCA202_0
(CYTOCHROME C')
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
4 / 5 ALA A 244
GLY A 299
LYS A 248
HIS A 249
None
None
None
HPX  A 406 (-3.4A)
1.47A 5jliA-3lm4A:
undetectable
5jliA-3lm4A:
15.03
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.20A 5z0fA-3lm4A:
undetectable
5z0fB-3lm4A:
undetectable
5z0fA-3lm4A:
12.06
5z0fB-3lm4A:
12.24
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.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.20A 5z0gA-3lm4A:
undetectable
5z0gB-3lm4A:
undetectable
5z0gA-3lm4A:
12.06
5z0gB-3lm4A:
12.24
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.
5Z0H_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.22A 5z0hA-3lm4A:
undetectable
5z0hB-3lm4A:
undetectable
5z0hA-3lm4A:
12.06
5z0hB-3lm4A:
12.24
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.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.21A 5z0iA-3lm4A:
undetectable
5z0iB-3lm4A:
undetectable
5z0iA-3lm4A:
12.06
5z0iB-3lm4A:
12.24
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.
5Z0J_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.22A 5z0jA-3lm4A:
undetectable
5z0jB-3lm4A:
undetectable
5z0jA-3lm4A:
12.06
5z0jB-3lm4A:
12.24
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.
5Z0K_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.22A 5z0kA-3lm4A:
undetectable
5z0kB-3lm4A:
undetectable
5z0kA-3lm4A:
12.06
5z0kB-3lm4A:
12.24
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.
5Z0L_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.21A 5z0lA-3lm4A:
undetectable
5z0lB-3lm4A:
undetectable
5z0lA-3lm4A:
12.06
5z0lB-3lm4A:
12.24
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.
5Z0M_B_DAHB98_0
(MELC
TYROSINASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 11 HIS A 249
HIS A 217
ASN A 157
HIS A 155
VAL A 202
HPX  A 406 (-3.4A)
FE  A 400 ( 3.4A)
PEO  A 401 ( 4.1A)
FE  A 400 ( 3.5A)
None
1.25A 5z0mA-3lm4A:
undetectable
5z0mB-3lm4A:
undetectable
5z0mA-3lm4A:
12.06
5z0mB-3lm4A:
12.24
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.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)
3lm4 CATECHOL
2,3-DIOXYGENASE

(Rhodococcus
jostii)
5 / 12 PHE A 309
ALA A 165
THR A 178
ILE A 251
MET A 289
HPX  A 406 (-4.7A)
None
None
HPX  A 406 ( 3.9A)
HPX  A 406 ( 4.6A)
1.15A 6aybA-3lm4A:
undetectable
6aybA-3lm4A:
22.77