SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'QEL'

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.	3QEL_B_QELB1_1 (NMDA GLUTAMATE RECEPTOR SUBUNIT GLUTAMATE [NMDA] RECEPTOR SUBUNIT EPSILON-2)	4pe5	GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B (Rattus norvegicus)	7 / 11	ALA B 107 GLN B 110 ILE B 111 PHE B 114 THR B 174 PRO B 177 GLU B 236	QEL B 920 ( 3.9A) QEL B 920 (-3.0A) QEL B 920 (-4.6A) QEL B 920 (-3.6A) None QEL B 920 (-4.6A) QEL B 920 (-2.9A)	0.28A	3qelA-4pe5B: 18.7 3qelB-4pe5B: 36.0	3qelA-4pe5B: 18.61 3qelB-4pe5B: 99.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3QEL_D_QELD2_2 (GLUTAMATE [NMDA] RECEPTOR SUBUNIT EPSILON-2)	4pe5	GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B (Rattus norvegicus)	9 / 9	PRO B 78 ALA B 107 GLN B 110 ILE B 111 PHE B 114 THR B 174 PHE B 176 PRO B 177 GLU B 236	None QEL B 920 ( 3.9A) QEL B 920 (-3.0A) QEL B 920 (-4.6A) QEL B 920 (-3.6A) None None QEL B 920 (-4.6A) QEL B 920 (-2.9A)	0.32A	3qelD-4pe5B: 24.5	3qelD-4pe5B: 99.73
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.	5EWJ_B_QELB503_1 (NMDA GLUTAMATE RECEPTOR SUBUNIT GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B)	4pe5	GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B (Rattus norvegicus)	7 / 11	PRO B 78 ALA B 107 GLN B 110 ILE B 111 PHE B 114 PRO B 177 GLU B 236	None QEL B 920 ( 3.9A) QEL B 920 (-3.0A) QEL B 920 (-4.6A) QEL B 920 (-3.6A) QEL B 920 (-4.6A) QEL B 920 (-2.9A)	0.35A	5ewjA-4pe5B: 18.7 5ewjB-4pe5B: 36.1	5ewjA-4pe5B: 18.60 5ewjB-4pe5B: 99.45
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.	5EWJ_D_QELD503_1 (NMDA GLUTAMATE RECEPTOR SUBUNIT GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B)	4pe5	GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B (Rattus norvegicus)	8 / 12	PRO B 78 ALA B 107 GLN B 110 ILE B 111 PHE B 114 THR B 174 PRO B 177 GLU B 236	None QEL B 920 ( 3.9A) QEL B 920 (-3.0A) QEL B 920 (-4.6A) QEL B 920 (-3.6A) None QEL B 920 (-4.6A) QEL B 920 (-2.9A)	0.36A	5ewjC-4pe5B: 15.9 5ewjD-4pe5B: 35.7	5ewjC-4pe5B: 18.60 5ewjD-4pe5B: 99.45

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3QEL_B_QELB1_1","NMDA GLUTAMATE RECEPTOR SUBUNIT;GLUTAMATE [NMDA] RECEPTOR SUBUNIT EPSILON-2","4pe5","GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","Rattus norvegicus",7,"ALA B 107;GLN B 110;ILE B 111;PHE B 114;THR B 174;PRO B 177;GLU B 236","QEL B 920 ( 3.9A);QEL B 920 (-3.0A);QEL B 920 (-4.6A);QEL B 920 (-3.6A);None;QEL B 920 (-4.6A);QEL B 920 (-2.9A)","0.28A","3qelA-4pe5B:18.7;3qelB-4pe5B:36.0",null],["3QEL_D_QELD2_2","GLUTAMATE [NMDA] RECEPTOR SUBUNIT EPSILON-2","4pe5","GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","Rattus norvegicus",9,"PRO B  78;ALA B 107;GLN B 110;ILE B 111;PHE B 114;THR B 174;PHE B 176;PRO B 177;GLU B 236","None;QEL B 920 ( 3.9A);QEL B 920 (-3.0A);QEL B 920 (-4.6A);QEL B 920 (-3.6A);None;None;QEL B 920 (-4.6A);QEL B 920 (-2.9A)","0.32A","3qelD-4pe5B:24.5","3qelA-4pe5B:18.61;3qelB-4pe5B:99.73"],["5EWJ_B_QELB503_1","NMDA GLUTAMATE RECEPTOR SUBUNIT;GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","4pe5","GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","Rattus norvegicus",7,"PRO B  78;ALA B 107;GLN B 110;ILE B 111;PHE B 114;PRO B 177;GLU B 236","None;QEL B 920 ( 3.9A);QEL B 920 (-3.0A);QEL B 920 (-4.6A);QEL B 920 (-3.6A);QEL B 920 (-4.6A);QEL B 920 (-2.9A)","0.35A","5ewjA-4pe5B:18.7;5ewjB-4pe5B:36.1","3qelD-4pe5B:99.73"],["5EWJ_D_QELD503_1","NMDA GLUTAMATE RECEPTOR SUBUNIT;GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","4pe5","GLUTAMATE RECEPTOR IONOTROPIC, NMDA 2B","Rattus norvegicus",8,"PRO B  78;ALA B 107;GLN B 110;ILE B 111;PHE B 114;THR B 174;PRO B 177;GLU B 236","None;QEL B 920 ( 3.9A);QEL B 920 (-3.0A);QEL B 920 (-4.6A);QEL B 920 (-3.6A);None;QEL B 920 (-4.6A);QEL B 920 (-2.9A)","0.36A","5ewjC-4pe5B:15.9;5ewjD-4pe5B:35.7","5ewjA-4pe5B:18.60;5ewjB-4pe5B:99.45"]]