SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3rof'

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.
1ERR_B_RALB600_2
(ESTROGEN RECEPTOR)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		4 / 6 ASP A  77
MET A  85
MET A  22
LEU A 107
 None
 1.15A 1errB-3rofA:
undetectable		 1errB-3rofA:
19.59
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.
2F78_A_BEZA1001_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		5 / 9 LEU A 151
ILE A 145
LEU A  26
ARG A  29
ILE A  31
 None
 1.18A 2f78A-3rofA:
undetectable		 2f78A-3rofA:
21.33
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.
3W9T_C_W9TC1005_1
(HEMOLYTIC LECTIN
CEL-III)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		3 / 3 ASP A 120
GLY A  10
TYR A 122
 PO4  A 201 (-2.8A)
PO4  A 201 (-3.5A)
None
 0.76A 3w9tC-3rofA:
undetectable		 3w9tC-3rofA:
16.90
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.
3W9T_G_W9TG503_1
(HEMOLYTIC LECTIN
CEL-III)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		3 / 3 ASP A 120
GLY A  10
TYR A 122
 PO4  A 201 (-2.8A)
PO4  A 201 (-3.5A)
None
 0.77A 3w9tG-3rofA:
undetectable		 3w9tG-3rofA:
16.90
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.
4OBW_A_SAMA602_1
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		3 / 3 ASP A 120
ASN A 125
SER A  15
 PO4  A 201 (-2.8A)
None
None
 0.84A 4obwA-3rofA:
3.7		 4obwA-3rofA:
20.53
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.
5EWU_A_BEZA1401_0
(MAGNESIUM-CHELATASE
SUBUNIT CHLH,
CHLOROPLASTIC)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		4 / 6 GLY A  40
THR A  41
SER A  15
VAL A   7
 None
 0.99A 5ewuA-3rofA:
undetectable		 5ewuA-3rofA:
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.
5EWU_B_BEZB1401_0
(MAGNESIUM-CHELATASE
SUBUNIT CHLH,
CHLOROPLASTIC)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		4 / 6 GLY A  40
THR A  41
SER A  15
VAL A   7
 None
 0.97A 5ewuB-3rofA:
undetectable		 5ewuB-3rofA:
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.
5I3C_C_AC2C301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		5 / 11 GLY A  40
ALA A   5
VAL A   7
GLU A  19
SER A  43
 None
 0.93A 5i3cC-3rofA:
undetectable		 5i3cC-3rofA:
23.55
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.
6DJZ_A_GMJA301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3rof LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE PTPA
(Staphylococcus
aureus) 		5 / 12 ILE A 142
PHE A   6
VAL A  83
ALA A 149
TYR A  -3
 None
 1.06A 6djzA-3rofA:
undetectable		 6djzA-3rofA:
18.75