SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3n3t'

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.
3RAE_H_LFXH101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		4 / 5 SER A 653
GLY A 665
GLU A 720
GLU A 699
 None
 1.39A 3raeB-3n3tA:
undetectable
3raeD-3n3tA:
undetectable		 3raeB-3n3tA:
21.93
3raeD-3n3tA:
22.29
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.
4KF9_A_ACTA407_0
(GLUTATHIONE
S-TRANSFERASE
PROTEIN)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		3 / 3 GLU A 614
ARG A 642
HIS A 664
 None
 0.66A 4kf9A-3n3tA:
undetectable		 4kf9A-3n3tA:
24.58
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.
4Z2D_F_LFXF102_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		3 / 4 ARG A 642
GLY A 665
GLU A 699
 None
 0.68A 4z2dB-3n3tA:
undetectable
4z2dC-3n3tA:
undetectable		 4z2dB-3n3tA:
19.81
4z2dC-3n3tA:
26.69
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.
5A06_A_SORA1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		5 / 7 CYH A 562
LEU A 581
GLU A 614
GLY A 521
GLY A 522
 None
 1.43A 5a06A-3n3tA:
undetectable		 5a06A-3n3tA:
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.
5A06_C_SORC1342_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		5 / 7 CYH A 562
LEU A 581
GLU A 614
GLY A 521
GLY A 522
 None
 1.43A 5a06C-3n3tA:
undetectable		 5a06C-3n3tA:
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.
5A06_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		5 / 7 CYH A 562
LEU A 581
GLU A 614
GLY A 521
GLY A 522
 None
 1.44A 5a06E-3n3tA:
undetectable		 5a06E-3n3tA:
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.
5A06_F_SORF1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		5 / 7 CYH A 562
LEU A 581
GLU A 614
GLY A 521
GLY A 522
 None
 1.43A 5a06F-3n3tA:
undetectable		 5a06F-3n3tA:
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.
5IGI_A_ZITA402_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		4 / 6 PRO A 662
GLU A 591
ALA A 598
LEU A 559
 None
 0.79A 5igiA-3n3tA:
undetectable		 5igiA-3n3tA:
24.28
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.
5VCV_A_1N1A404_2
(MEMBRANE-ASSOCIATED
TYROSINE- AND
THREONINE-SPECIFIC
CDC2-INHIBITORY
KINASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		4 / 5 VAL A 641
LEU A 633
CYH A 632
ASP A 600
 None
 1.39A 5vcvA-3n3tA:
undetectable		 5vcvA-3n3tA:
27.16
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.
6B52_A_OAQA302_0
(SULFOTRANSFERASE)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		5 / 12 ILE A 617
VAL A 629
LEU A 615
PHE A 663
THR A 596
 None
 1.23A 6b52A-3n3tA:
undetectable		 6b52A-3n3tA:
20.13
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.
6DJZ_C_GMJC301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3n3t PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE
(Thiobacillus
denitrificans) 		4 / 6 LEU A 613
ASP A 646
GLN A 670
GLU A 616
 None
MG  A 802 (-2.7A)
C2E  A 801 (-3.3A)
MG  A 802 (-3.2A)
 1.37A 6djzC-3n3tA:
undetectable		 6djzC-3n3tA:
21.81