SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'PXU'


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.
3A51_B_VDYB6178_1
(VITAMIN D
HYDROXYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 12 LEU A 107
ILE A 150
VAL A 141
PRO A 136
LEU A 138
 None
None
None
PXU  A 171 ( 4.9A)
None
 1.05A 3a51B-4l1gA:
undetectable		 3a51B-4l1gA:
22.07
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.
3A51_C_VDYC6178_1
(VITAMIN D
HYDROXYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 12 LEU A 107
ILE A 150
VAL A 141
PRO A 136
LEU A 138
 None
None
None
PXU  A 171 ( 4.9A)
None
 1.01A 3a51C-4l1gA:
undetectable		 3a51C-4l1gA:
22.07
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.
3A51_C_VDYC6178_1
(VITAMIN D
HYDROXYLASE)		 5o6y PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 12 LEU B 107
ILE B 150
VAL B 141
PRO B 136
LEU B 138
 None
None
None
NA  B 311 ( 4.6A)
PXU  B 171 ( 4.9A)
 1.04A 3a51C-5o6yB:
undetectable		 3a51C-5o6yB:
10.22
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.
3AVP_A_MV2A313_1
(PANTOTHENATE KINASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		4 / 7 ASP A  81
HIS A 135
LEU A 223
ILE A 175
 ACT  A 302 ( 4.0A)
PXU  A 171 (-3.6A)
None
None
 0.98A 3avpA-4l1gA:
undetectable		 3avpA-4l1gA:
20.00
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.
3AVP_A_MV2A313_1
(PANTOTHENATE KINASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		4 / 7 ASP A  81
HIS A 135
LEU A 223
ILE A 190
 ACT  A 302 ( 4.0A)
PXU  A 171 (-3.6A)
None
None
 0.91A 3avpA-4l1gA:
undetectable		 3avpA-4l1gA:
20.00
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.
3K8M_A_ACRA720_1
(ALPHA-AMYLASE, SUSG)		 5jp6 PUTATIVE
POLYSACCHARIDE
DEACETYLASE
(Bdellovibrio
bacteriovorus) 		4 / 7 GLU A  47
TRP A  46
LEU A  92
ASN A  37
 PXU  A 279 ( 4.2A)
None
None
None
 1.30A 3k8mA-5jp6A:
2.2		 3k8mA-5jp6A:
18.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NCD_A_ACTA301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 6 ASP A  80
ASP A  81
HIS A 131
HIS A 135
HIS A 225
 ACT  A 302 (-3.8A)
ACT  A 302 ( 4.0A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
ACT  A 302 (-4.0A)
 0.33A 5ncdA-4l1gA:
24.4
5ncdD-4l1gA:
24.7		 5ncdA-4l1gA:
34.83
5ncdD-4l1gA:
34.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NCD_C_ACTC301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 6 ASP A  80
ASP A  81
HIS A 131
HIS A 135
HIS A 225
 ACT  A 302 (-3.8A)
ACT  A 302 ( 4.0A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
ACT  A 302 (-4.0A)
 0.20A 5ncdB-4l1gA:
24.6
5ncdC-4l1gA:
24.6		 5ncdB-4l1gA:
34.83
5ncdC-4l1gA:
34.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NCD_D_ACTD301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		4 / 4 ASP A  80
HIS A 131
HIS A 135
HIS A 225
 ACT  A 302 (-3.8A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
ACT  A 302 (-4.0A)
 0.28A 5ncdD-4l1gA:
24.7		 5ncdD-4l1gA:
34.83
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.
5NEK_B_AZMB302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		6 / 8 ASP A  80
ASP A  81
HIS A 131
HIS A 135
TRP A 200
HIS A 225
 ACT  A 302 (-3.8A)
ACT  A 302 ( 4.0A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
None
ACT  A 302 (-4.0A)
 0.54A 5nekB-4l1gA:
24.6		 5nekB-4l1gA:
20.19
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.
5NEK_D_AZMD302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		7 / 8 ASP A  80
ASP A  81
HIS A 131
HIS A 135
TRP A 193
TRP A 200
HIS A 225
 ACT  A 302 (-3.8A)
ACT  A 302 ( 4.0A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
None
None
ACT  A 302 (-4.0A)
 0.56A 5nekD-4l1gA:
24.4		 5nekD-4l1gA:
20.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NEL_A_ACTA302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 6 ASP A  80
ASP A  81
HIS A 131
HIS A 135
HIS A 225
 ACT  A 302 (-3.8A)
ACT  A 302 ( 4.0A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
ACT  A 302 (-4.0A)
 0.36A 5nelA-4l1gA:
24.4
5nelD-4l1gA:
24.4		 5nelA-4l1gA:
34.83
5nelD-4l1gA:
34.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5NEL_C_ACTC302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4l1g PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Bacillus
cereus) 		5 / 6 ASP A  80
HIS A 131
HIS A 135
LEU A 223
HIS A 225
 ACT  A 302 (-3.8A)
PXU  A 171 ( 3.8A)
PXU  A 171 (-3.6A)
None
ACT  A 302 (-4.0A)
 0.31A 5nelB-4l1gA:
24.5
5nelC-4l1gA:
24.5		 5nelB-4l1gA:
34.83
5nelC-4l1gA:
34.83