SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'IDE'


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.
1TV8_A_SAMA1501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 7 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.19A 1tv8A-2j7cA:
7.3		 1tv8A-2j7cA:
20.33
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 8 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.16A 2fb2A-2j7cA:
2.5		 2fb2A-2j7cA:
20.78
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.
2FB2_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		4 / 7 TYR A 435
GLU A 351
THR A  16
VAL A  73
 None
IDE  A1446 (-2.5A)
None
None
 1.16A 2fb2B-2j7cA:
3.6		 2fb2B-2j7cA:
20.78
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.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		5 / 11 ASN A 165
GLU A 166
TYR A 295
GLU A 351
TRP A 398
 IDE  A1446 (-3.1A)
IDE  A1446 (-2.5A)
IDE  A1446 (-3.5A)
IDE  A1446 (-2.5A)
IDE  A1446 (-3.6A)
 0.84A 2v3dB-2j7cA:
16.6		 2v3dB-2j7cA:
23.01
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.
3HRD_E_NIOE5660_1
(NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 GLU A 408
GLU A 405
TRP A 324
 None
IDE  A1446 (-2.8A)
None
 1.01A 3hrdA-2j7cA:
undetectable
3hrdE-2j7cA:
undetectable
3hrdF-2j7cA:
undetectable		 3hrdA-2j7cA:
19.51
3hrdE-2j7cA:
19.51
3hrdF-2j7cA:
23.33
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.
4LRH_B_FOLB301_1
(FOLATE RECEPTOR
ALPHA)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASP A 123
TRP A 398
SER A  79
 None
IDE  A1446 (-3.6A)
None
 0.95A 4lrhB-2j7cA:
undetectable		 4lrhB-2j7cA:
16.67
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.
4LRH_F_FOLF301_1
(FOLATE RECEPTOR
ALPHA)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASP A 123
TRP A 398
SER A  79
 None
IDE  A1446 (-3.6A)
None
 1.04A 4lrhF-2j7cA:
undetectable		 4lrhF-2j7cA:
16.67
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.
4U15_A_0HKA2001_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 ASN A 165
PHE A 396
TYR A  76
 IDE  A1446 (-3.1A)
None
None
 0.66A 4u15A-2j7cA:
undetectable		 4u15A-2j7cA:
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.
5LAK_I_BEZI1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 SER A 296
TYR A 295
TYR A 294
 None
IDE  A1446 (-3.5A)
None
 0.74A 5lakA-2j7cA:
undetectable
5lakI-2j7cA:
undetectable		 5lakA-2j7cA:
21.79
5lakI-2j7cA:
3.42
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.
5LAK_J_BEZJ1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 2j7c BETA-GLUCOSIDASE A
(Thermotoga
maritima) 		3 / 3 SER A 296
TYR A 295
TYR A 294
 None
IDE  A1446 (-3.5A)
None
 0.62A 5lakC-2j7cA:
undetectable
5lakJ-2j7cA:
undetectable		 5lakC-2j7cA:
21.79
5lakJ-2j7cA:
3.42