SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '8BR'


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.
1S3Z_B_RIOB501_0
(AMINOGLYCOSIDE
6'-N-ACETYLTRANSFERA
SE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		4 / 8 GLU A 298
VAL A 297
ARG A 341
HIS A 267
 8BR  A 501 ( 4.6A)
8BR  A 502 ( 4.5A)
None
None
 1.29A 1s3zA-5o0jA:
undetectable
1s3zB-5o0jA:
undetectable		 1s3zA-5o0jA:
undetectable
1s3zB-5o0jA:
undetectable
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.
2YJA_B_ESTB1550_1
(ESTROGEN RECEPTOR)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		5 / 12 ALA A 271
GLU A 298
MET A 120
ILE A 119
GLY A 115
 None
8BR  A 501 ( 4.6A)
None
None
GLC  A 503 (-3.7A)
 1.13A 2yjaB-5o0jA:
undetectable		 2yjaB-5o0jA:
16.06
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.
2ZUL_A_SAMA376_1
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		3 / 3 SER A 446
GLU A 296
ASP A 319
 None
8BR  A 501 ( 4.7A)
None
 0.66A 2zulA-5o0jA:
4.1		 2zulA-5o0jA:
undetectable
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.
3DMH_A_SAMA384_1
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		3 / 3 SER A 446
GLU A 296
ASP A 319
 None
8BR  A 501 ( 4.7A)
None
 0.70A 3dmhA-5o0jA:
3.6		 3dmhA-5o0jA:
undetectable
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.
3THR_C_C2FC1410_0
(GLYCINE
N-METHYLTRANSFERASE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		3 / 3 ARG A 200
PRO A 196
PHE A 184
 8BR  A 501 (-3.2A)
None
None
 0.72A 3thrC-5o0jA:
undetectable		 3thrC-5o0jA:
undetectable
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.
3UBO_A_ADNA353_1
(ADENOSINE KINASE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		6 / 12 ASP A  37
GLY A 114
GLY A 115
ARG A 200
GLY A 440
ASP A 443
 GLC  A 503 (-2.7A)
GLC  A 503 (-3.5A)
GLC  A 503 (-3.7A)
8BR  A 501 (-3.2A)
GLC  A 503 ( 4.1A)
GLC  A 503 (-2.6A)
 0.63A 3uboA-5o0jA:
24.2		 3uboA-5o0jA:
12.94
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.
5GS4_A_ESTA603_1
(ESTROGEN RECEPTOR)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		5 / 12 ALA A 271
GLU A 298
MET A 120
ILE A 119
GLY A 115
 None
8BR  A 501 ( 4.6A)
None
None
GLC  A 503 (-3.7A)
 1.11A 5gs4A-5o0jA:
undetectable		 5gs4A-5o0jA:
17.14
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.
5IFU_A_GBMA801_1
(PROLINE--TRNA LIGASE)		 5o0j ADP-DEPENDENT
GLUCOKINASE
(Pyrococcus
horikoshii) 		5 / 12 TYR A 347
THR A 438
ILE A 441
GLY A 442
ILE A 445
 8BR  A 501 (-4.3A)
8BR  A 501 ( 4.3A)
8BR  A 501 (-3.4A)
8BR  A 501 ( 3.9A)
None
 0.71A 5ifuA-5o0jA:
2.7		 5ifuA-5o0jA:
10.91