SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1bqb'

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.
1LQT_A_ACTA1869_0
(FPRA)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 4 ASP A 172
HIS A 144
ARG A 200
GLU A 168
 None
ZN  A 350 (-3.3A)
None
ZN  A 350 (-2.2A)
 0.90A 1lqtA-1bqbA:
1.6		 1lqtA-1bqbA:
21.87
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.
1V54_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 1v54A-1bqbA:
undetectable
1v54C-1bqbA:
0.1		 1v54A-1bqbA:
20.96
1v54C-1bqbA:
21.39
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.
1V54_P_CHDP4525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 1v54N-1bqbA:
undetectable
1v54P-1bqbA:
0.1		 1v54N-1bqbA:
20.96
1v54P-1bqbA:
21.39
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.
1V55_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 1v55A-1bqbA:
undetectable
1v55C-1bqbA:
0.1		 1v55A-1bqbA:
20.96
1v55C-1bqbA:
21.39
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.
1V7Z_A_CRNA401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.18A 1v7zA-1bqbA:
undetectable		 1v7zA-1bqbA:
19.62
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.
1V7Z_B_CRNB3401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.18A 1v7zB-1bqbA:
undetectable		 1v7zB-1bqbA:
19.62
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.
1V7Z_C_CRNC4401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.19A 1v7zC-1bqbA:
undetectable		 1v7zC-1bqbA:
19.62
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.
1V7Z_D_CRND5401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.20A 1v7zD-1bqbA:
undetectable		 1v7zD-1bqbA:
19.62
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.
1V7Z_E_CRNE6401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.19A 1v7zE-1bqbA:
undetectable		 1v7zE-1bqbA:
19.62
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.
1V7Z_F_CRNF7401_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.19A 1v7zF-1bqbA:
undetectable		 1v7zF-1bqbA:
19.62
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.
2C6N_A_LPRA705_1
(ANGIOTENSIN-CONVERTI
NG ENZYME, SOMATIC
ISOFORM)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 12 ALA A 115
HIS A 144
GLU A 145
HIS A 148
GLU A 168
 None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
ZN  A 350 (-3.3A)
ZN  A 350 (-2.2A)
 0.49A 2c6nA-1bqbA:
6.6		 2c6nA-1bqbA:
18.43
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.
2DYR_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.19A 2dyrA-1bqbA:
undetectable
2dyrC-1bqbA:
0.1		 2dyrA-1bqbA:
20.96
2dyrC-1bqbA:
21.39
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.
2DYR_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 2dyrN-1bqbA:
0.0
2dyrP-1bqbA:
0.1		 2dyrN-1bqbA:
20.96
2dyrP-1bqbA:
21.39
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.
2DYS_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.23A 2dysA-1bqbA:
0.3
2dysC-1bqbA:
0.1		 2dysA-1bqbA:
20.96
2dysC-1bqbA:
21.39
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.
2EIJ_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.21A 2eijA-1bqbA:
0.6
2eijC-1bqbA:
0.1		 2eijA-1bqbA:
20.96
2eijC-1bqbA:
21.39
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.
2EIJ_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 2eijN-1bqbA:
0.6
2eijP-1bqbA:
0.1		 2eijN-1bqbA:
20.96
2eijP-1bqbA:
21.39
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.
2EIK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 2eikA-1bqbA:
0.3
2eikC-1bqbA:
0.2		 2eikA-1bqbA:
20.96
2eikC-1bqbA:
21.39
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.
2EIK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 2eikN-1bqbA:
0.3
2eikP-1bqbA:
0.1		 2eikN-1bqbA:
20.96
2eikP-1bqbA:
21.39
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.
2EIL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 2eilA-1bqbA:
0.3
2eilC-1bqbA:
undetectable		 2eilA-1bqbA:
20.96
2eilC-1bqbA:
21.39
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.
2EIL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.23A 2eilN-1bqbA:
undetectable
2eilP-1bqbA:
undetectable		 2eilN-1bqbA:
20.96
2eilP-1bqbA:
21.39
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.
2EIM_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.17A 2eimA-1bqbA:
0.3
2eimC-1bqbA:
0.1		 2eimA-1bqbA:
20.96
2eimC-1bqbA:
21.39
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.
2EIM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 2eimN-1bqbA:
0.3
2eimP-1bqbA:
0.1		 2eimN-1bqbA:
20.96
2eimP-1bqbA:
21.39
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.
2EIN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 2einA-1bqbA:
0.3
2einC-1bqbA:
undetectable		 2einA-1bqbA:
20.96
2einC-1bqbA:
21.39
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.
2Y69_A_CHDA1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.24A 2y69A-1bqbA:
undetectable
2y69C-1bqbA:
undetectable		 2y69A-1bqbA:
20.96
2y69C-1bqbA:
21.39
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.
2ZXW_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.21A 2zxwA-1bqbA:
0.3
2zxwC-1bqbA:
0.1		 2zxwA-1bqbA:
20.96
2zxwC-1bqbA:
21.39
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.
3A6J_A_CRNA303_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.15A 3a6jA-1bqbA:
undetectable		 3a6jA-1bqbA:
19.62
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.
3A6J_B_CRNB304_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 7 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.14A 3a6jB-1bqbA:
undetectable		 3a6jB-1bqbA:
19.62
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.
3A6J_C_CRNC305_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.14A 3a6jC-1bqbA:
undetectable		 3a6jC-1bqbA:
19.62
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.
3A6J_E_CRNE306_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.15A 3a6jE-1bqbA:
undetectable		 3a6jE-1bqbA:
19.62
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.
3A6J_F_CRNF307_1
(CREATININE
AMIDOHYDROLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 8 GLU A 168
HIS A 144
HIS A 228
HIS A 148
GLU A 145
 ZN  A 350 (-2.2A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
 1.14A 3a6jF-1bqbA:
undetectable		 3a6jF-1bqbA:
19.62
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.
3ABK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 3abkA-1bqbA:
0.5
3abkC-1bqbA:
0.1		 3abkA-1bqbA:
20.96
3abkC-1bqbA:
21.39
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.
3ABK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.23A 3abkN-1bqbA:
undetectable
3abkP-1bqbA:
undetectable		 3abkN-1bqbA:
20.96
3abkP-1bqbA:
21.39
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.
3AG1_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.24A 3ag1A-1bqbA:
0.4
3ag1C-1bqbA:
0.0		 3ag1A-1bqbA:
20.96
3ag1C-1bqbA:
21.39
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.
3AG2_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.21A 3ag2A-1bqbA:
0.3
3ag2C-1bqbA:
undetectable		 3ag2A-1bqbA:
20.96
3ag2C-1bqbA:
21.39
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.
3AG3_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.25A 3ag3A-1bqbA:
0.4
3ag3C-1bqbA:
0.2		 3ag3A-1bqbA:
20.96
3ag3C-1bqbA:
21.39
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.
3AG3_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.25A 3ag3N-1bqbA:
0.5
3ag3P-1bqbA:
0.1		 3ag3N-1bqbA:
20.96
3ag3P-1bqbA:
21.39
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.
3AG4_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 3ag4A-1bqbA:
0.0
3ag4C-1bqbA:
0.1		 3ag4A-1bqbA:
20.96
3ag4C-1bqbA:
21.39
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.
3ASN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 3asnA-1bqbA:
0.4
3asnC-1bqbA:
0.2		 3asnA-1bqbA:
20.96
3asnC-1bqbA:
21.39
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.
3ASN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 3asnC-1bqbA:
0.2
3asnN-1bqbA:
0.6
3asnP-1bqbA:
0.1		 3asnC-1bqbA:
21.39
3asnN-1bqbA:
20.96
3asnP-1bqbA:
21.39
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.
3ASO_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.20A 3asoA-1bqbA:
0.4
3asoC-1bqbA:
0.1
3asoP-1bqbA:
0.1		 3asoA-1bqbA:
20.96
3asoC-1bqbA:
21.39
3asoP-1bqbA:
21.39
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.
3FRQ_A_ERYA195_1
(REPRESSOR PROTEIN
MPHR(A))		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 5 ASN A  71
ASN A  41
HIS A 102
ALA A  66
 None
 1.14A 3frqA-1bqbA:
0.0		 3frqA-1bqbA:
20.59
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.
3FRQ_B_ERYB195_1
(REPRESSOR PROTEIN
MPHR(A))		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 ASN A  71
ASN A  41
HIS A 102
ALA A  66
 None
 1.17A 3frqB-1bqbA:
0.0		 3frqB-1bqbA:
20.59
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.
3KEC_B_HAEB271_1
(COLLAGENASE 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		3 / 3 HIS A 144
GLU A 145
HIS A 148
 ZN  A 350 (-3.3A)
ZN  A 350 ( 4.6A)
ZN  A 350 (-3.3A)
 0.19A 3kecB-1bqbA:
3.2		 3kecB-1bqbA:
21.71
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.
4APJ_A_ACTA1635_0
(ANGIOTENSIN-CONVERTI
NG ENZYME
BRADYKININ-POTENTIAT
ING PEPTIDE B)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 HIS A 148
GLU A 168
ASP A 172
SER A 231
 ZN  A 350 (-3.3A)
ZN  A 350 (-2.2A)
None
None
 1.00A 4apjA-1bqbA:
5.1
4apjP-1bqbA:
undetectable		 4apjA-1bqbA:
19.76
4apjP-1bqbA:
17.07
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.
4FEU_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 ASP A 140
ASP A 128
GLU A 145
GLU A 187
 CA  A 351 (-3.3A)
None
ZN  A 350 ( 4.6A)
CA  A 351 ( 2.3A)
 0.92A 4feuD-1bqbA:
undetectable		 4feuD-1bqbA:
22.78
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.
4LV9_A_20JA602_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 VAL A 291
ILE A 253
ARG A 256
ALA A 257
 None
 0.85A 4lv9A-1bqbA:
undetectable		 4lv9A-1bqbA:
21.29
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.
4MJ8_A_SPMA201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 MET A 122
GLU A 145
TYR A  73
TYR A 190
 None
ZN  A 350 ( 4.6A)
None
None
 1.14A 4mj8A-1bqbA:
0.0
4mj8C-1bqbA:
0.0		 4mj8A-1bqbA:
19.27
4mj8C-1bqbA:
19.27
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.
4PAH_A_LNRA600_1
(PHENYLALANINE
HYDROXYLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 HIS A 144
HIS A 148
TYR A 159
GLU A 168
 ZN  A 350 (-3.3A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-2.2A)
 0.89A 4pahA-1bqbA:
undetectable		 4pahA-1bqbA:
21.86
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.
4PAH_A_LNRA600_1
(PHENYLALANINE
HYDROXYLASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 LEU A 258
HIS A 148
HIS A 144
GLU A 168
 None
ZN  A 350 (-3.3A)
ZN  A 350 (-3.3A)
ZN  A 350 (-2.2A)
 1.02A 4pahA-1bqbA:
undetectable		 4pahA-1bqbA:
21.86
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.
4WZM_A_ACTA503_0
(RNA DEPENDENT RNA
POLYMERASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 4 ASP A 140
ASP A 188
ASP A 182
ALA A 138
 CA  A 351 (-3.3A)
CA  A 352 ( 4.2A)
CA  A 351 ( 2.8A)
None
 1.42A 4wzmA-1bqbA:
0.1		 4wzmA-1bqbA:
20.73
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.
5B1A_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 5b1aA-1bqbA:
0.2
5b1aC-1bqbA:
0.1
5b1aP-1bqbA:
0.1		 5b1aA-1bqbA:
20.96
5b1aC-1bqbA:
21.39
5b1aP-1bqbA:
21.39
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.
5B3S_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 8 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.24A 5b3sA-1bqbA:
0.3
5b3sC-1bqbA:
0.1
5b3sP-1bqbA:
0.1		 5b3sA-1bqbA:
20.96
5b3sC-1bqbA:
21.39
5b3sP-1bqbA:
21.39
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.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 12 ALA A 274
SER A 231
ILE A 233
TYR A 217
MET A 214
 None
 1.13A 5igvA-1bqbA:
0.0		 5igvA-1bqbA:
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.
5PAH_A_LDPA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 4 HIS A 144
HIS A 148
TYR A 159
GLU A 168
 ZN  A 350 (-3.3A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-2.2A)
 0.91A 5pahA-1bqbA:
undetectable		 5pahA-1bqbA:
21.86
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.
5WAU_C_CHDC303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.22A 5wauC-1bqbA:
0.1
5waua-1bqbA:
0.0
5wauc-1bqbA:
0.1		 5wauC-1bqbA:
21.39
5waua-1bqbA:
20.96
5wauc-1bqbA:
21.39
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.
5X1B_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.21A 5x1bN-1bqbA:
0.5
5x1bP-1bqbA:
0.1		 5x1bN-1bqbA:
20.96
5x1bP-1bqbA:
21.39
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.
5ZCQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 7 THR A  77
TYR A  78
TRP A 117
HIS A 148
 None
None
None
ZN  A 350 (-3.3A)
 1.23A 5zcqN-1bqbA:
0.3
5zcqP-1bqbA:
0.1		 5zcqN-1bqbA:
20.96
5zcqP-1bqbA:
21.39
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.
6B0C_D_TA1D502_1
(TUBULIN BETA CHAIN)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		5 / 12 VAL A 300
GLU A 301
LEU A 157
LEU A 262
THR A 263
 None
 0.82A 6b0cD-1bqbA:
undetectable		 6b0cD-1bqbA:
13.33
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.
6GB9_A_ACTA508_0
(MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN
CNX1)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		3 / 3 VAL A 178
ALA A 143
GLN A  76
 None
 0.69A 6gb9A-1bqbA:
1.4		 6gb9A-1bqbA:
20.43
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.
6PAH_A_DAHA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 1bqb PROTEIN (AUREOLYSIN)
(Staphylococcus
aureus) 		4 / 6 HIS A 144
HIS A 148
TYR A 159
GLU A 168
 ZN  A 350 (-3.3A)
ZN  A 350 (-3.3A)
None
ZN  A 350 (-2.2A)
 0.90A 6pahA-1bqbA:
undetectable		 6pahA-1bqbA:
21.86