SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MAB'

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 (%)
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.	1FFY_A_MRCA1993_2 (ISOLEUCYL-TRNA SYNTHETASE)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	4 / 6	PRO A 170 TRP A 56 GLU A 205 TRP A 114	None GOL A 411 (-4.0A) MAB A 401 (-3.9A) MAB A 401 (-3.6A)	1.30A	1ffyA-1qnrA: 0.3	1ffyA-1qnrA: 16.76
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.	2AOW_A_THAA400_1 (HISTAMINE N-METHYLTRANSFERASE)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	4 / 7	GLN A 307 TYR A 243 TRP A 56 GLU A 169	None GOL A 410 (-3.6A) GOL A 411 (-4.0A) MAB A 401 ( 2.8A)	1.23A	2aowA-1qnrA: undetectable	2aowA-1qnrA: 22.99
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.	2V3D_A_NBVA1503_1 (GLUCOSYLCERAMIDASE)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	6 / 12	ASN A 168 GLU A 169 HIS A 241 TYR A 243 GLU A 276 TRP A 306	None MAB A 401 ( 2.8A) None GOL A 410 (-3.6A) GOL A 410 (-3.8A) GOL A 410 (-3.6A)	0.95A	2v3dA-1qnrA: 6.1	2v3dA-1qnrA: 20.95
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.	4KN2_C_LYAC304_2 (FOLATE RECEPTOR BETA)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	3 / 3	TYR A 117 GLN A 307 TRP A 114	None None MAB A 401 (-3.6A)	0.93A	4kn2C-1qnrA: 0.0	4kn2C-1qnrA: 19.60
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.	4MI4_A_SPMA201_1 (SPERMIDINE N1-ACETYLTRANSFERASE)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	4 / 6	ASN A 168 GLU A 165 GLU A 169 GLU A 205	None None MAB A 401 ( 2.8A) MAB A 401 (-3.9A)	1.43A	4mi4A-1qnrA: 0.9	4mi4A-1qnrA: 19.20
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.	5KGP_B_GCSB405_1 (PREDICTED ACETYLTRANSFERASE)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	4 / 8	ARG A 171 GLU A 205 PRO A 217 GLY A 208	MAB A 401 (-2.7A) MAB A 401 (-3.9A) None None	1.11A	5kgpB-1qnrA: 1.1	5kgpB-1qnrA: 20.47
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.	6GNE_B_ACRB602_2 (-)	1qnr	ENDO-1,4-B-D-MANNANA SE (Trichoderma reesei)	4 / 8	VAL A 111 TYR A 144 TYR A 135 GLU A 205	None None None MAB A 401 (-3.9A)	1.28A	6gneB-1qnrA: 2.5	6gneB-1qnrA: 20.73

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1FFY_A_MRCA1993_2","ISOLEUCYL-TRNA SYNTHETASE","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",4,"PRO A 170;TRP A  56;GLU A 205;TRP A 114","None;GOL A 411 (-4.0A);MAB A 401 (-3.9A);MAB A 401 (-3.6A)","1.30A","1ffyA-1qnrA:0.3",null],["2AOW_A_THAA400_1","HISTAMINE N-METHYLTRANSFERASE","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",4,"GLN A 307;TYR A 243;TRP A  56;GLU A 169","None;GOL A 410 (-3.6A);GOL A 411 (-4.0A);MAB A 401 ( 2.8A)","1.23A","2aowA-1qnrA:undetectable","1ffyA-1qnrA:16.76"],["2V3D_A_NBVA1503_1","GLUCOSYLCERAMIDASE","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",6,"ASN A 168;GLU A 169;HIS A 241;TYR A 243;GLU A 276;TRP A 306","None;MAB A 401 ( 2.8A);None;GOL A 410 (-3.6A);GOL A 410 (-3.8A);GOL A 410 (-3.6A)","0.95A","2v3dA-1qnrA:6.1","2aowA-1qnrA:22.99"],["4KN2_C_LYAC304_2","FOLATE RECEPTOR BETA","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",3,"TYR A 117;GLN A 307;TRP A 114","None;None;MAB A 401 (-3.6A)","0.93A","4kn2C-1qnrA:0.0","2v3dA-1qnrA:20.95"],["4MI4_A_SPMA201_1","SPERMIDINE N1-ACETYLTRANSFERASE","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",4,"ASN A 168;GLU A 165;GLU A 169;GLU A 205","None;None;MAB A 401 ( 2.8A);MAB A 401 (-3.9A)","1.43A","4mi4A-1qnrA:0.9","4kn2C-1qnrA:19.60"],["5KGP_B_GCSB405_1","PREDICTED ACETYLTRANSFERASE","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",4,"ARG A 171;GLU A 205;PRO A 217;GLY A 208","MAB A 401 (-2.7A);MAB A 401 (-3.9A);None;None","1.11A","5kgpB-1qnrA:1.1","4mi4A-1qnrA:19.20"],["6GNE_B_ACRB602_2","-","1qnr","ENDO-1,4-B-D-MANNANASE","Trichoderma reesei",4,"VAL A 111;TYR A 144;TYR A 135;GLU A 205","None;None;None;MAB A 401 (-3.9A)","1.28A","6gneB-1qnrA:2.5","5kgpB-1qnrA:20.47"]]