SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'KLS'


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.
2A3A_A_TEPA1433_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 11 TYR A  34
PHE A  60
GLY A 123
GLU A 174
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.59A 2a3aA-2xvnA:
21.3		 2a3aA-2xvnA:
23.15
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.
2A3A_B_TEPB2433_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		5 / 9 PHE A  60
GLY A 123
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.61A 2a3aB-2xvnA:
21.2		 2a3aB-2xvnA:
23.15
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.
2A3B_B_CFFB2435_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 10 PHE A  60
GLY A 123
ASP A 172
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 1.16A 2a3bB-2xvnA:
21.1		 2a3bB-2xvnA:
23.15
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.
2A3C_A_PNXA1434_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		7 / 12 TYR A  34
PHE A  60
GLY A 123
ASP A 172
GLU A 174
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 1.18A 2a3cA-2xvnA:
21.2		 2a3cA-2xvnA:
23.15
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.
2A3C_B_PNXB2433_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 12 PHE A  60
GLY A 123
ASP A 172
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 1.16A 2a3cB-2xvnA:
21.1		 2a3cB-2xvnA:
23.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2UY4_A_AZMA1311_1
(ENDOCHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		5 / 9 TYR A  34
PHE A  60
GLY A 122
ASP A 172
GLN A 230
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-3.2A)
 1.09A 2uy4A-2xvnA:
40.4		 2uy4A-2xvnA:
42.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2UY4_A_AZMA1311_1
(ENDOCHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		9 / 9 TYR A  34
PHE A  60
GLY A 123
ALA A 124
ASP A 172
GLU A 174
GLN A 230
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-3.3A)
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-3.2A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.48A 2uy4A-2xvnA:
40.4		 2uy4A-2xvnA:
42.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XTK_A_AZMA1339_1
(CLASS III CHITINASE
CHIA1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		11 / 11 TYR A  34
PHE A  60
GLY A 123
ALA A 124
ASP A 172
GLU A 174
GLN A 230
TYR A 232
ASN A 233
ALA A 280
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-3.3A)
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-3.2A)
KLS  A1338 (-4.8A)
None
None
KLS  A1338 (-3.5A)
 0.46A 2xtkA-2xvnA:
54.0		 2xtkA-2xvnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XTK_A_AZMA1339_1
(CLASS III CHITINASE
CHIA1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		8 / 11 TYR A  34
PHE A  60
GLY A 123
ALA A 124
ASP A 172
TYR A 232
ALA A 279
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-3.3A)
KLS  A1338 (-2.8A)
KLS  A1338 (-4.8A)
None
KLS  A1338 (-3.5A)
 1.12A 2xtkA-2xvnA:
54.0		 2xtkA-2xvnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XTK_B_AZMB1339_1
(CLASS III CHITINASE
CHIA1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		9 / 10 TYR A  34
PHE A  60
GLY A 123
ALA A 124
ASP A 172
GLU A 174
GLN A 230
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-3.3A)
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-3.2A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.36A 2xtkB-2xvnA:
54.4		 2xtkB-2xvnA:
100.00
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.
3AXT_A_SAMA397_0
(PROBABLE
N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE
TRM1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		5 / 12 ALA A 205
ILE A 229
ILE A 121
SER A 120
ASP A 212
 KLS  A1338 ( 4.3A)
None
None
None
None
 1.13A 3axtA-2xvnA:
undetectable		 3axtA-2xvnA:
21.08
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.
3G6M_A_CFFA1_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 11 TYR A  34
PHE A  60
GLY A 123
ASP A 172
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 1.03A 3g6mA-2xvnA:
21.2		 3g6mA-2xvnA:
23.53
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.
3G6M_A_CFFA1_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 11 TYR A  34
PHE A  60
GLY A 123
GLU A 174
TYR A 232
TRP A 312
 KLS  A1338 (-3.4A)
None
None
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.66A 3g6mA-2xvnA:
21.2		 3g6mA-2xvnA:
23.53
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.
3WQV_A_GCSA501_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 11 PHE A  60
GLY A 123
ASP A 172
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.55A 3wqvA-2xvnA:
20.9		 3wqvA-2xvnA:
20.55
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.
3WQW_A_GCSA501_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		6 / 11 PHE A  60
GLY A 123
ASP A 172
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.8A)
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.54A 3wqwA-2xvnA:
21.0		 3wqwA-2xvnA:
20.55
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.
4FE1_A_PQNA846_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		5 / 10 PHE A 140
ALA A 147
LEU A 144
ALA A  32
MET A 310
 None
None
None
None
KLS  A1338 ( 4.9A)
 1.44A 4fe1A-2xvnA:
undetectable
4fe1J-2xvnA:
undetectable		 4fe1A-2xvnA:
18.54
4fe1J-2xvnA:
10.33
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.
4XEY_A_1N1A601_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		3 / 3 MET A 310
ASP A 172
PHE A 171
 KLS  A1338 ( 4.9A)
KLS  A1338 (-2.8A)
None
 0.88A 4xeyA-2xvnA:
undetectable		 4xeyA-2xvnA:
21.36
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.
4XEY_B_1N1B601_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		3 / 3 MET A 310
ASP A 172
PHE A 171
 KLS  A1338 ( 4.9A)
KLS  A1338 (-2.8A)
None
 0.85A 4xeyB-2xvnA:
undetectable		 4xeyB-2xvnA:
21.36
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.
5GQB_A_GCSA603_1
(CHITINASE)		 2xvn ASPERGILLUS
FUMIGATUS CHITINASE
A1
(Aspergillus
fumigatus) 		5 / 8 PHE A  60
GLY A 123
GLU A 174
TYR A 232
TRP A 312
 None
None
KLS  A1338 (-2.9A)
KLS  A1338 (-4.8A)
KLS  A1338 (-3.5A)
 0.62A 5gqbA-2xvnA:
19.8		 5gqbA-2xvnA:
20.96