SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2w8s'

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_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.81A 1errB-2w8sA:
undetectable
1errB-2w8sA:
18.92
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.
1UKB_A_BEZA1301_0
(2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 LEU A 308
PHE A 305
ALA A 306
LEU A 200
None
0.99A 1ukbA-2w8sA:
undetectable
1ukbA-2w8sA:
20.30
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)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 1v54A-2w8sA:
undetectable
1v54C-2w8sA:
undetectable
1v54A-2w8sA:
19.33
1v54C-2w8sA:
17.78
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.
1V54_P_CHDP4525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 1v54N-2w8sA:
undetectable
1v54P-2w8sA:
undetectable
1v54N-2w8sA:
19.33
1v54P-2w8sA:
17.78
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.
1V55_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 1v55A-2w8sA:
undetectable
1v55C-2w8sA:
undetectable
1v55A-2w8sA:
19.33
1v55C-2w8sA:
17.78
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.
2DYR_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.26A 2dyrA-2w8sA:
undetectable
2dyrC-2w8sA:
undetectable
2dyrA-2w8sA:
19.33
2dyrC-2w8sA:
17.78
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.
2DYR_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 2dyrN-2w8sA:
undetectable
2dyrP-2w8sA:
undetectable
2dyrN-2w8sA:
19.33
2dyrP-2w8sA:
17.78
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.
2DYS_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 2dysA-2w8sA:
undetectable
2dysC-2w8sA:
undetectable
2dysA-2w8sA:
19.33
2dysC-2w8sA:
17.78
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.
2DYS_P_CHDP304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.31A 2dysN-2w8sA:
undetectable
2dysP-2w8sA:
undetectable
2dysN-2w8sA:
19.33
2dysP-2w8sA:
17.78
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.
2EIJ_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 2eijA-2w8sA:
undetectable
2eijC-2w8sA:
undetectable
2eijA-2w8sA:
19.33
2eijC-2w8sA:
17.78
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.
2EIJ_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.31A 2eijN-2w8sA:
undetectable
2eijP-2w8sA:
undetectable
2eijN-2w8sA:
19.33
2eijP-2w8sA:
17.78
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.
2EIK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 2eikA-2w8sA:
undetectable
2eikC-2w8sA:
undetectable
2eikA-2w8sA:
19.33
2eikC-2w8sA:
17.78
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.
2EIK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 2eikN-2w8sA:
undetectable
2eikP-2w8sA:
undetectable
2eikN-2w8sA:
19.33
2eikP-2w8sA:
17.78
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.
2EIL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.26A 2eilA-2w8sA:
undetectable
2eilC-2w8sA:
undetectable
2eilA-2w8sA:
19.33
2eilC-2w8sA:
17.78
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.
2EIL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 2eilN-2w8sA:
undetectable
2eilP-2w8sA:
undetectable
2eilN-2w8sA:
19.33
2eilP-2w8sA:
17.78
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.
2EIM_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 2eimA-2w8sA:
undetectable
2eimC-2w8sA:
undetectable
2eimA-2w8sA:
19.33
2eimC-2w8sA:
17.78
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.
2EIM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 2eimN-2w8sA:
undetectable
2eimP-2w8sA:
undetectable
2eimN-2w8sA:
19.33
2eimP-2w8sA:
17.78
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.
2EIN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 2einA-2w8sA:
undetectable
2einC-2w8sA:
undetectable
2einA-2w8sA:
19.33
2einC-2w8sA:
17.78
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.
2EIN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.33A 2einN-2w8sA:
undetectable
2einP-2w8sA:
undetectable
2einN-2w8sA:
19.33
2einP-2w8sA:
17.78
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.
2F8L_A_SAMA400_0
(HYPOTHETICAL PROTEIN
LMO1582)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 GLY A  67
ASN A  88
LEU A  89
ASP A 390
LEU A  68
None
0.95A 2f8lA-2w8sA:
undetectable
2f8lA-2w8sA:
20.29
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.
2JFA_A_RALA600_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.84A 2jfaA-2w8sA:
undetectable
2jfaA-2w8sA:
19.12
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.
2PLW_A_SAMA203_1
(RIBOSOMAL RNA
METHYLTRANSFERASE,
PUTATIVE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 SER A  63
ASP A 372
ASP A 390
None
0.78A 2plwA-2w8sA:
2.2
2plwA-2w8sA:
16.38
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.
2Q6H_A_CXXA801_1
(TRANSPORTER)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 11 LEU A  22
ARG A  24
ILE A  19
LEU A  37
ASP A  38
None
1.28A 2q6hA-2w8sA:
undetectable
2q6hA-2w8sA:
22.13
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.
2QXS_A_RALA600_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.88A 2qxsA-2w8sA:
undetectable
2qxsA-2w8sA:
18.33
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.
2QXS_B_RALB600_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.90A 2qxsB-2w8sA:
undetectable
2qxsB-2w8sA:
18.33
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.
2WEK_A_DIFA1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 8 PHE A 450
TYR A 412
PHE A 458
ASN A 469
None
0.97A 2wekA-2w8sA:
undetectable
2wekA-2w8sA:
21.47
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.
2WEK_B_DIFB1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 8 PHE A 450
TYR A 412
PHE A 458
ASN A 469
None
0.94A 2wekB-2w8sA:
undetectable
2wekB-2w8sA:
21.47
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)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 2y69A-2w8sA:
undetectable
2y69C-2w8sA:
undetectable
2y69A-2w8sA:
19.33
2y69C-2w8sA:
17.78
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.
2ZXW_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 2zxwA-2w8sA:
undetectable
2zxwC-2w8sA:
undetectable
2zxwA-2w8sA:
19.33
2zxwC-2w8sA:
17.78
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.
2ZXW_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 2zxwN-2w8sA:
undetectable
2zxwP-2w8sA:
undetectable
2zxwN-2w8sA:
19.33
2zxwP-2w8sA:
17.78
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.
3A51_B_VDYB6178_1
(VITAMIN D
HYDROXYLASE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 PRO A 386
THR A 385
LEU A 378
THR A 322
VAL A  10
None
1.33A 3a51B-2w8sA:
undetectable
3a51B-2w8sA:
23.26
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)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 3abkA-2w8sA:
undetectable
3abkC-2w8sA:
undetectable
3abkA-2w8sA:
19.33
3abkC-2w8sA:
17.78
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.
3ABK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.26A 3abkN-2w8sA:
undetectable
3abkP-2w8sA:
undetectable
3abkN-2w8sA:
19.33
3abkP-2w8sA:
17.78
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.
3ABM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 3abmN-2w8sA:
undetectable
3abmP-2w8sA:
undetectable
3abmN-2w8sA:
19.33
3abmP-2w8sA:
17.78
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.
3AG1_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 3ag1A-2w8sA:
undetectable
3ag1C-2w8sA:
undetectable
3ag1A-2w8sA:
19.33
3ag1C-2w8sA:
17.78
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.
3AG1_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 3ag1N-2w8sA:
undetectable
3ag1P-2w8sA:
undetectable
3ag1N-2w8sA:
19.33
3ag1P-2w8sA:
17.78
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.
3AG2_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 3ag2A-2w8sA:
undetectable
3ag2C-2w8sA:
undetectable
3ag2A-2w8sA:
19.33
3ag2C-2w8sA:
17.78
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.
3AG2_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.33A 3ag2N-2w8sA:
undetectable
3ag2P-2w8sA:
undetectable
3ag2N-2w8sA:
19.33
3ag2P-2w8sA:
17.78
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.
3AG3_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 3ag3A-2w8sA:
undetectable
3ag3C-2w8sA:
undetectable
3ag3A-2w8sA:
19.33
3ag3C-2w8sA:
17.78
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.
3AG3_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 3ag3N-2w8sA:
undetectable
3ag3P-2w8sA:
undetectable
3ag3N-2w8sA:
19.33
3ag3P-2w8sA:
17.78
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.
3AG4_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.30A 3ag4A-2w8sA:
undetectable
3ag4C-2w8sA:
undetectable
3ag4A-2w8sA:
19.33
3ag4C-2w8sA:
17.78
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.
3AG4_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 3ag4N-2w8sA:
undetectable
3ag4P-2w8sA:
undetectable
3ag4N-2w8sA:
19.33
3ag4P-2w8sA:
17.78
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.
3ASN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.26A 3asnA-2w8sA:
undetectable
3asnC-2w8sA:
undetectable
3asnA-2w8sA:
19.33
3asnC-2w8sA:
17.78
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.
3E23_A_SAMA221_1
(UNCHARACTERIZED
PROTEIN RPA2492)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 TYR A 290
ASP A  17
HIS A 325
None
None
ZN  A1515 ( 3.2A)
0.92A 3e23A-2w8sA:
undetectable
3e23A-2w8sA:
18.01
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.
3ELZ_B_CHDB152_0
(ILEAL BILE
ACID-BINDING PROTEIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 ASN A  72
HIS A  73
VAL A  76
None
0.61A 3elzB-2w8sA:
undetectable
3elzB-2w8sA:
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.
3JUS_B_ECLB600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 8 THR A 109
GLY A  58
ALA A  62
THR A  66
None
FGL  A  57 ( 2.7A)
None
None
0.80A 3jusB-2w8sA:
undetectable
3jusB-2w8sA:
21.70
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.
3TGV_B_BEZB1_0
(HEME-BINDING PROTEIN
HUTZ)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 ARG A 407
PHE A 397
PRO A 403
LEU A 394
SO4  A1517 (-4.4A)
None
None
None
1.41A 3tgvB-2w8sA:
undetectable
3tgvB-2w8sA:
14.55
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.
3TGV_C_BEZC1_0
(HEME-BINDING PROTEIN
HUTZ)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 5 ARG A 407
PHE A 397
PRO A 403
LEU A 394
SO4  A1517 (-4.4A)
None
None
None
1.38A 3tgvC-2w8sA:
undetectable
3tgvC-2w8sA:
14.55
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.
3UPR_A_1KXA277_1
(HLA CLASS I
HISTOCOMPATIBILITY
ANTIGEN, B-57 ALPHA
CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 10 TYR A 199
ILE A 103
VAL A 135
SER A 134
ILE A 128
None
1.46A 3uprA-2w8sA:
undetectable
3uprA-2w8sA:
20.85
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.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 8 PHE A  47
GLY A 366
GLY A 361
ASN A 357
None
0.99A 3v3nB-2w8sA:
undetectable
3v3nB-2w8sA:
20.68
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.
3WIP_G_ACTG306_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 ARG A  28
ARG A  48
ASP A  17
None
1.01A 3wipG-2w8sA:
undetectable
3wipH-2w8sA:
undetectable
3wipG-2w8sA:
17.47
3wipH-2w8sA:
17.47
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.
4A97_J_ZPCJ1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 8 TYR A 340
VAL A 439
ILE A 440
GLU A 343
None
0.99A 4a97I-2w8sA:
undetectable
4a97I-2w8sA:
19.39
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.
4A97_J_ZPCJ1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 5 GLU A 466
GLU A 441
PHE A 458
TYR A 412
None
1.23A 4a97J-2w8sA:
undetectable
4a97J-2w8sA:
19.39
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.
4PTH_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 ASP A 309
LEU A 308
PHE A 305
None
0.71A 4pthA-2w8sA:
undetectable
4pthA-2w8sA:
15.31
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.
4QC6_B_KANB201_2
(BIFUNCTIONAL AAC/APH)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 LEU A 479
ASP A 482
TYR A 483
None
0.55A 4qc6B-2w8sA:
undetectable
4qc6B-2w8sA:
15.38
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.
4XI3_B_29SB601_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.89A 4xi3B-2w8sA:
undetectable
4xi3B-2w8sA:
17.84
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.
4XI3_C_29SC601_1
(ESTROGEN RECEPTOR)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 THR A 193
ALA A 196
LEU A 200
LEU A 210
LEU A 102
None
0.92A 4xi3C-2w8sA:
undetectable
4xi3C-2w8sA:
17.84
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.
4XK8_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 MET A 129
PHE A 132
ALA A  92
LEU A  93
None
1.08A 4xk8A-2w8sA:
undetectable
4xk8A-2w8sA:
21.47
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_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 5b1aN-2w8sA:
undetectable
5b1aP-2w8sA:
undetectable
5b1aN-2w8sA:
19.33
5b1aP-2w8sA:
17.78
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.
5B1B_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 5b1bN-2w8sA:
undetectable
5b1bP-2w8sA:
undetectable
5b1bN-2w8sA:
19.33
5b1bP-2w8sA:
17.78
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.
5B3S_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.29A 5b3sN-2w8sA:
undetectable
5b3sP-2w8sA:
undetectable
5b3sN-2w8sA:
19.33
5b3sP-2w8sA:
17.78
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.
5IY5_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.31A 5iy5A-2w8sA:
undetectable
5iy5C-2w8sA:
undetectable
5iy5A-2w8sA:
19.33
5iy5C-2w8sA:
17.94
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.
5L8D_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 THR A 277
PRO A 245
ASP A 246
None
0.83A 5l8dB-2w8sA:
undetectable
5l8dB-2w8sA:
23.20
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.
5MWU_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
3 / 3 THR A 277
PRO A 245
ASP A 246
None
0.83A 5mwuB-2w8sA:
undetectable
5mwuB-2w8sA:
23.20
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.
5TIX_B_OQRB302_0
(SULFOTRANSFERASE)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 10 ILE A 347
LEU A  22
VAL A 350
LEU A  45
GLU A 364
None
1.30A 5tixB-2w8sA:
undetectable
5tixB-2w8sA:
17.77
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.
5U98_A_1KXA301_1
(HLA CLASS I
HISTOCOMPATIBILITY
ANTIGEN, B-57 ALPHA
CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 10 TYR A 199
ILE A 103
VAL A 135
SER A 134
ILE A 128
None
1.46A 5u98A-2w8sA:
3.4
5u98A-2w8sA:
20.85
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.
5U98_D_1KXD301_1
(HLA CLASS I
HISTOCOMPATIBILITY
ANTIGEN, B-57 ALPHA
CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 10 TYR A 199
ILE A 103
VAL A 135
SER A 134
ILE A 128
None
1.47A 5u98D-2w8sA:
2.4
5u98D-2w8sA:
20.85
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.
5V1T_A_SAMA605_0
(RADICAL SAM)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 PHE A 209
LEU A  65
THR A 106
VAL A 135
TYR A 199
None
1.49A 5v1tA-2w8sA:
undetectable
5v1tA-2w8sA:
21.13
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.
5VC0_A_RITA602_2
(CYTOCHROME P450 3A4)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 ILE A 377
LEU A 349
PHE A  47
THR A  53
None
0.78A 5vc0A-2w8sA:
undetectable
5vc0A-2w8sA:
21.60
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.
5X19_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 5x19N-2w8sA:
undetectable
5x19P-2w8sA:
undetectable
5x19N-2w8sA:
19.33
5x19P-2w8sA:
17.78
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.
5X1B_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 5x1bN-2w8sA:
undetectable
5x1bP-2w8sA:
undetectable
5x1bN-2w8sA:
19.33
5x1bP-2w8sA:
17.78
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.
5X1F_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 LEU A  87
MET A 374
THR A 376
LEU A 378
None
1.05A 5x1fA-2w8sA:
undetectable
5x1fJ-2w8sA:
undetectable
5x1fA-2w8sA:
19.33
5x1fJ-2w8sA:
8.11
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.
5X1F_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.32A 5x1fN-2w8sA:
undetectable
5x1fP-2w8sA:
undetectable
5x1fN-2w8sA:
19.33
5x1fP-2w8sA:
17.78
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.
5ZCQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.28A 5zcqN-2w8sA:
undetectable
5zcqP-2w8sA:
undetectable
5zcqN-2w8sA:
19.33
5zcqP-2w8sA:
17.78
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.
6EW0_B_TA1B501_1
(TUBULIN BETA CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 VAL A 373
ASP A 372
LEU A  40
LEU A  37
LEU A 398
None
1.01A 6ew0B-2w8sA:
undetectable
6ew0B-2w8sA:
9.35
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.
6EW0_D_TA1D501_1
(TUBULIN BETA CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 VAL A 373
ASP A 372
LEU A  40
LEU A  37
LEU A 398
None
1.01A 6ew0D-2w8sA:
undetectable
6ew0D-2w8sA:
9.35
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.
6EW0_H_TA1H501_1
(TUBULIN BETA CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 VAL A 373
ASP A 372
LEU A  40
LEU A  37
LEU A 398
None
1.01A 6ew0H-2w8sA:
undetectable
6ew0H-2w8sA:
9.35
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.
6EW0_I_TA1I501_1
(TUBULIN BETA CHAIN)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 VAL A 373
ASP A 372
LEU A  40
LEU A  37
LEU A 398
None
1.01A 6ew0I-2w8sA:
undetectable
6ew0I-2w8sA:
9.35
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.
6GNF_C_QPSC602_1
(-)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 10 GLY A 336
TYR A 290
TRP A  14
HIS A 325
VAL A  55
None
None
None
ZN  A1515 ( 3.2A)
None
1.33A 6gnfC-2w8sA:
undetectable
6gnfC-2w8sA:
20.07
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.
6GNG_A_QPSA601_2
(-)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 GLY A 336
TYR A 290
TRP A  14
HIS A 325
VAL A  55
None
None
None
ZN  A1515 ( 3.2A)
None
1.37A 6gngA-2w8sA:
undetectable
6gngA-2w8sA:
22.31
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.
6GNG_B_QPSB601_1
(-)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
5 / 12 TYR A 290
TRP A  14
HIS A 325
VAL A  55
GLY A 339
None
None
ZN  A1515 ( 3.2A)
None
None
1.47A 6gngB-2w8sA:
undetectable
6gngB-2w8sA:
22.31
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.
6NKN_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.31A 6nknA-2w8sA:
undetectable
6nknC-2w8sA:
undetectable
6nknA-2w8sA:
19.33
6nknC-2w8sA:
17.78
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.
6NMP_C_CHDC303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 6 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.27A 6nmpA-2w8sA:
undetectable
6nmpC-2w8sA:
undetectable
6nmpA-2w8sA:
19.33
6nmpC-2w8sA:
17.78
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.
6NMP_P_CHDP302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
2w8s PHOSPHONATE
MONOESTER HYDROLASE

(Paraburkholderia
caryophylli)
4 / 7 HIS A 411
ASP A 482
TYR A 447
HIS A 494
None
None
None
SO4  A1517 (-4.1A)
1.31A 6nmpN-2w8sA:
undetectable
6nmpP-2w8sA:
undetectable
6nmpN-2w8sA:
19.33
6nmpP-2w8sA:
17.78