POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)1) User may click on the DrReposER ID (the second column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.

	DrReposER ID / Desc.	Hit PDBID	Hit Macromolecule	Res. Matches	Interface	HETATM	RMSD	Seq. Identity (%)	View	Dock
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2V3D_A_NBVA1503_1 (GLUCOSYLCERAMIDASE)	3keh	GLUCOCEREBROSIDASE (Homo sapiens)	7 / 12	ASP A 127 TRP A 179 ASN A 234 GLU A 235 HIS A 311 GLU A 340 TRP A 381	None	0.32A	99.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2V3D_A_NBVA1503_1 (GLUCOSYLCERAMIDASE)	3keh	GLUCOCEREBROSIDASE (Homo sapiens)	6 / 12	ASP A 127 TRP A 179 ASN A 234 GLU A 340 TRP A 381 ASN A 392	None	1.32A	99.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2V3D_A_NBVA1503_1 (GLUCOSYLCERAMIDASE)	3keh	GLUCOCEREBROSIDASE (Homo sapiens)	7 / 12	ASP A 127 TRP A 179 ASN A 234 HIS A 311 TYR A 313 GLU A 340 TRP A 381	None	0.73A	99.60
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_A_NBVA1503_1 (GLUCOSYLCERAMIDASE)	5e9c	HEPARANASE (Homo sapiens)	5 / 12	ASN A 224 GLU A 225 HIS A 296 TYR A 298 GLU A 343	IDR  A 606 (-3.2A) 5KV  A 608 (-2.8A) None IDR  A 606 (-4.4A) IDR  A 606 (-2.4A)	0.60A	24.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2V3D_B_NBVB1504_1 (GLUCOSYLCERAMIDASE)	3keh	GLUCOCEREBROSIDASE (Homo sapiens)	7 / 11	ASP A 127 TRP A 179 ASN A 234 GLU A 235 TYR A 313 GLU A 340 TRP A 381	None	0.77A	99.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2V3D_B_NBVB1504_1 (GLUCOSYLCERAMIDASE)	3keh	GLUCOCEREBROSIDASE (Homo sapiens)	6 / 11	ASP A 127 TRP A 179 ASN A 234 GLU A 340 TRP A 381 ASN A 392	None	1.28A	99.60
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.	5IEF_A_NBVA1005_1 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3ctt	MALTASE-GLUCOAMYLASE (Homo sapiens)	10 / 12	ASP A 327 ILE A 328 ILE A 364 TRP A 441 ASP A 443 MET A 444 PHE A 450 ASP A 542 PHE A 575 HIS A 600	3CU  A1001 (-2.7A) 3CU  A1001 ( 3.9A) 3CU  A1001 (-4.5A) 3CU  A1001 (-4.9A) 3CU  A1001 (-2.7A) 3CU  A1001 ( 3.9A) None 3CU  A1001 ( 2.5A) 3CU  A1001 (-4.5A) 3CU  A1001 (-3.9A)	0.47A	29.99
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.	5IEF_A_NBVA1005_1 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3lpp	SUCRASE-ISOMALTASE (Homo sapiens)	11 / 12	TRP A 327 ASP A 355 ILE A 356 ILE A 392 TRP A 470 ASP A 472 MET A 473 PHE A 479 ASP A 571 PHE A 604 HIS A 629	TRS  A6001 ( 3.8A) TRS  A6001 (-2.9A) TRS  A6001 ( 4.0A) None None TRS  A6001 (-3.2A) TRS  A6001 ( 3.7A) None TRS  A6001 ( 3.7A) TRS  A6001 (-4.4A) TRS  A6001 (-4.2A)	0.46A	29.16
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.	5IEF_A_NBVA1005_1 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3top	MALTASE-GLUCOAMYLASE , INTESTINAL (Homo sapiens)	10 / 12	ASP A1279 ILE A1280 ILE A1315 TRP A1418 ASP A1420 MET A1421 PHE A1427 ASP A1526 PHE A1559 HIS A1584	ACR  A   1 (-3.2A) ACR  A   1 (-4.1A) None None ACR  A   1 (-3.6A) ACR  A   1 (-3.5A) None ACR  A   1 (-2.8A) ACR  A   1 (-4.3A) ACR  A   1 (-3.9A)	0.53A	27.17
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.	5IEF_A_NBVA1005_1 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3top	MALTASE-GLUCOAMYLASE , INTESTINAL (Homo sapiens)	6 / 12	ASP A1279 ILE A1280 MET A1421 ASP A1526 PHE A1559 HIS A1584	ACR  A   1 (-3.2A) ACR  A   1 (-4.1A) ACR  A   1 (-3.5A) ACR  A   1 (-2.8A) ACR  A   1 (-4.3A) ACR  A   1 (-3.9A)	1.46A	27.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	5IEF_A_NBVA1005_1 (NEUTRAL ALPHA-GLUCOSIDASE AB)	5nn8	LYSOSOMAL ALPHA-GLUCOSIDASE (Homo sapiens)	10 / 12	TRP A 376 ASP A 404 ILE A 441 TRP A 516 ASP A 518 MET A 519 PHE A 525 ASP A 616 PHE A 649 HIS A 674	ACR  A1015 ( 4.6A) ACR  A1015 (-3.0A) ACR  A1015 (-4.3A) None ACR  A1015 (-3.1A) ACR  A1015 (-3.3A) None ACR  A1015 (-2.7A) ACR  A1015 (-4.3A) ACR  A1015 (-4.0A)	0.58A	31.52
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.	5IEF_A_NBVA1005_2 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3ctt	MALTASE-GLUCOAMYLASE (Homo sapiens)	4 / 4	ARG A 526 TRP A 539 ASP A 571 ARG A 598	3CU  A1001 ( 3.5A) 3CU  A1001 (-4.6A) 3CU  A1001 ( 4.8A) 3CU  A1001 ( 4.7A)	0.41A	29.99
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.	5IEF_A_NBVA1005_2 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3lpp	SUCRASE-ISOMALTASE (Homo sapiens)	4 / 4	ARG A 555 TRP A 568 ASP A 600 ARG A 627	TRS  A6001 ( 4.6A) None None None	0.24A	29.16
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.	5IEF_A_NBVA1005_2 (NEUTRAL ALPHA-GLUCOSIDASE AB)	3top	MALTASE-GLUCOAMYLASE , INTESTINAL (Homo sapiens)	4 / 4	ARG A1510 TRP A1523 ASP A1555 ARG A1582	ACR  A   1 (-2.9A) ACR  A   1 (-4.5A) None None	0.29A	27.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	5IEF_A_NBVA1005_2 (NEUTRAL ALPHA-GLUCOSIDASE AB)	5nn8	LYSOSOMAL ALPHA-GLUCOSIDASE (Homo sapiens)	4 / 4	ARG A 600 TRP A 613 ASP A 645 ARG A 672	ACR  A1015 (-3.1A) ACR  A1015 (-4.8A) None ACR  A1015 ( 4.8A)	0.18A	31.52