SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'PC1'


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.
1C4D_A_DVAA8_0
(GRAMICIDIN A)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans) 		3 / 3 VAL C  70
TRP C  65
TRP C  16
 PC1  C 302 (-4.3A)
None
None
 1.32A 1c4dA-1qleC:
undetectable
1c4dB-1qleC:
undetectable		 1c4dA-1qleC:
5.53
1c4dB-1qleC:
5.53
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.
1IGX_A_EPAA700_2
(PROSTAGLANDIN
ENDOPEROXIDE H
SYNTHASE-1)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 8 VAL A 433
TYR A 255
VAL A 254
LEU A 435
 None
None
PC1  A 777 (-4.8A)
None
 0.82A 1igxA-1bp1A:
0.0		 1igxA-1bp1A:
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.
1MJQ_D_SAMD200_0
(METHIONINE REPRESSOR)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
(Paracoccus
denitrificans) 		5 / 12 HIS A 326
PHE A 273
GLY A 275
ALA A 324
HIS A 325
 CU  A 603 ( 3.3A)
PC1  C 301 ( 4.8A)
None
None
CU  A 603 ( 3.4A)
 1.03A 1mjqC-1qleA:
undetectable
1mjqD-1qleA:
undetectable		 1mjqC-1qleA:
11.11
1mjqD-1qleA:
11.11
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.
1MJQ_J_SAMJ200_0
(METHIONINE REPRESSOR)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
(Paracoccus
denitrificans) 		5 / 12 HIS A 326
PHE A 273
GLY A 275
ALA A 324
HIS A 325
 CU  A 603 ( 3.3A)
PC1  C 301 ( 4.8A)
None
None
CU  A 603 ( 3.4A)
 1.02A 1mjqI-1qleA:
undetectable
1mjqJ-1qleA:
undetectable		 1mjqI-1qleA:
11.11
1mjqJ-1qleA:
11.11
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.
1U70_A_MTXA187_1
(DIHYDROFOLATE
REDUCTASE)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 ILE A 822
PHE A1306
GLN A1311
ASN A1304
LEU A1294
 None
None
PC1  A1915 (-3.7A)
None
None
 1.45A 1u70A-5gjvA:
undetectable		 1u70A-5gjvA:
8.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1V54_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 1v54A-1qleA:
54.5
1v54C-1qleA:
2.7		 1v54A-1qleA:
53.19
1v54C-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1V54_P_CHDP4525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 1v54N-1qleA:
54.5
1v54P-1qleA:
0.9		 1v54N-1qleA:
53.19
1v54P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1V55_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 1v55A-1qleA:
54.4
1v55C-1qleA:
2.7		 1v55A-1qleA:
53.19
1v55C-1qleA:
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.
1YA4_C_CTXC3_1
(CES1 PROTEIN)		 4m4d LIPOPOLYSACCHARIDE-B
INDING PROTEIN
(Mus
musculus) 		5 / 12 GLY A  46
VAL A 154
LEU A 103
SER A 102
LEU A 144
 PC1  A 506 (-3.4A)
None
PC1  A 506 (-4.8A)
None
None
 1.05A 1ya4C-4m4dA:
undetectable		 1ya4C-4m4dA:
23.43
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.
2BYO_A_LNLA1217_1
(LIPOPROTEIN LPPX)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 4 VAL A 254
LEU A 186
ILE A 130
LEU A  76
 PC1  A 777 (-4.8A)
PC1  A 777 (-4.7A)
None
None
 1.04A 2byoA-1bp1A:
2.3		 2byoA-1bp1A:
19.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DYR_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 2dyrA-1qleA:
54.5
2dyrC-1qleA:
2.7		 2dyrA-1qleA:
53.19
2dyrC-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DYR_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 2dyrN-1qleA:
54.5
2dyrP-1qleA:
2.7		 2dyrN-1qleA:
53.19
2dyrP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIJ_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 2eijA-1qleA:
54.4
2eijC-1qleA:
2.7		 2eijA-1qleA:
53.19
2eijC-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIJ_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 2eijN-1qleA:
54.4
2eijP-1qleA:
2.7		 2eijN-1qleA:
53.19
2eijP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 2eikA-1qleA:
54.4
2eikC-1qleA:
2.7		 2eikA-1qleA:
53.19
2eikC-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 2eikN-1qleA:
54.4
2eikP-1qleA:
2.7		 2eikN-1qleA:
53.19
2eikP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 2eilA-1qleA:
54.5
2eilC-1qleA:
2.7		 2eilA-1qleA:
53.19
2eilC-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EIL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 2eilN-1qleA:
54.5
2eilP-1qleA:
2.7		 2eilN-1qleA:
53.19
2eilP-1qleA:
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.
2HRE_B_CHDB701_0
(FERROCHELATASE)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE II
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		3 / 3 LYS C 110
GLY B 197
PRO B 196
 PC1  C 301 (-4.5A)
None
None
 0.81A 2hreB-1qleC:
undetectable		 2hreB-1qleC:
19.19
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.
2HZQ_A_STRA300_1
(APOLIPOPROTEIN D)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		4 / 7 THR A1132
ALA A1250
PHE A1125
LEU A 201
 PC1  A1912 (-4.3A)
None
None
None
 1.13A 2hzqA-5gjvA:
undetectable		 2hzqA-5gjvA:
7.00
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.
2RLF_C_RIMC399_1
(MATRIX PROTEIN 2)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 6 LEU A  29
LEU A  25
ILE A  32
ARG A  31
 None
PC1  A 777 ( 4.1A)
None
None
 0.99A 2rlfC-1bp1A:
0.0
2rlfD-1bp1A:
0.0		 2rlfC-1bp1A:
6.24
2rlfD-1bp1A:
6.24
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.
2VCV_E_ASDE1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 4m4d LIPOPOLYSACCHARIDE-B
INDING PROTEIN
(Mus
musculus) 		5 / 9 LEU A 144
PRO A 152
LEU A 232
LEU A 216
PHE A 247
 None
None
None
PC1  A 506 (-4.2A)
None
 1.28A 2vcvE-4m4dA:
undetectable		 2vcvE-4m4dA:
20.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2Y69_A_CHDA1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 2y69A-1qleA:
54.5
2y69C-1qleA:
2.7		 2y69A-1qleA:
53.19
2y69C-1qleA:
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.
2Y69_N_CHDN1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.53A 2y69C-1qleA:
2.7
2y69N-1qleA:
54.5
2y69P-1qleA:
2.7		 2y69C-1qleA:
20.59
2y69N-1qleA:
53.19
2y69P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ABK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 3abkA-1qleA:
54.3
3abkC-1qleA:
2.3		 3abkA-1qleA:
53.19
3abkC-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ABK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 3abkN-1qleA:
54.3
3abkP-1qleA:
2.7		 3abkN-1qleA:
53.19
3abkP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ABL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.67A 3ablA-1qleA:
54.4
3ablC-1qleA:
2.9
3ablP-1qleA:
2.7		 3ablA-1qleA:
53.19
3ablC-1qleA:
20.59
3ablP-1qleA:
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.
3ABL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.63A 3ablC-1qleA:
2.9
3ablN-1qleA:
54.4
3ablP-1qleA:
2.7		 3ablC-1qleA:
20.59
3ablN-1qleA:
53.19
3ablP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ABM_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 3abmA-1qleA:
54.4
3abmC-1qleA:
2.7
3abmP-1qleA:
2.7		 3abmA-1qleA:
53.19
3abmC-1qleA:
20.59
3abmP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ABM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 3abmN-1qleA:
54.4
3abmP-1qleA:
2.7		 3abmN-1qleA:
53.19
3abmP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG2_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.64A 3ag2A-1qleA:
54.4
3ag2C-1qleA:
2.7		 3ag2A-1qleA:
53.19
3ag2C-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG2_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 3ag2N-1qleA:
54.5
3ag2P-1qleA:
2.7		 3ag2N-1qleA:
53.19
3ag2P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG3_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 3ag3A-1qleA:
54.3
3ag3C-1qleA:
2.7		 3ag3A-1qleA:
53.19
3ag3C-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG3_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.62A 3ag3N-1qleA:
54.4
3ag3P-1qleA:
2.7		 3ag3N-1qleA:
53.19
3ag3P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG4_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 3ag4A-1qleA:
54.1
3ag4C-1qleA:
2.7		 3ag4A-1qleA:
53.19
3ag4C-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3AG4_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.51A 3ag4N-1qleA:
54.1
3ag4P-1qleA:
2.7		 3ag4N-1qleA:
53.19
3ag4P-1qleA:
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.
3ASN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 3asnC-1qleA:
2.7
3asnN-1qleA:
54.5
3asnP-1qleA:
2.7		 3asnC-1qleA:
20.59
3asnN-1qleA:
53.19
3asnP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ASO_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 3asoA-1qleA:
54.5
3asoC-1qleA:
2.7
3asoP-1qleA:
2.7		 3asoA-1qleA:
53.19
3asoC-1qleA:
20.59
3asoP-1qleA:
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.
3ASO_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 3asoC-1qleA:
2.7
3asoN-1qleA:
54.5
3asoP-1qleA:
2.7		 3asoC-1qleA:
20.59
3asoN-1qleA:
53.19
3asoP-1qleA:
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.
3BJW_C_SVRC505_2
(PHOSPHOLIPASE A2)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans) 		4 / 5 VAL C  69
VAL C  70
GLN C 243
PHE C  90
 PC1  C 302 (-4.2A)
PC1  C 302 (-4.3A)
PC1  C 302 (-2.9A)
PC1  C 302 (-4.4A)
 1.37A 3bjwH-1qleC:
0.5		 3bjwH-1qleC:
14.34
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.
3BWM_A_SAMA301_0
(CATECHOL
O-METHYLTRANSFERASE)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 ASN A 654
VAL A 655
GLY A 648
TYR A 650
ILE A 643
 None
None
None
PC1  A1906 ( 4.8A)
PC1  A1903 ( 4.5A)
 1.35A 3bwmA-5gjvA:
undetectable		 3bwmA-5gjvA:
7.62
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.
3GWW_A_SFXA801_1
(TRANSPORTER)		 4m4d LIPOPOLYSACCHARIDE-B
INDING PROTEIN
(Mus
musculus) 		5 / 12 LEU A  50
GLY A  46
ILE A 201
ALA A 104
ASP A 141
 PC1  A 506 ( 4.5A)
PC1  A 506 (-3.4A)
None
None
None
 1.02A 3gwwA-4m4dA:
undetectable		 3gwwA-4m4dA:
22.34
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.
3JW5_B_TOPB208_1
(DIHYDROFOLATE
REDUCTASE)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 10 ALA A1266
LEU A 914
VAL A 917
ILE A1274
LEU A1371
 None
None
None
PC1  A1915 ( 4.6A)
None
 1.15A 3jw5B-5gjvA:
undetectable		 3jw5B-5gjvA:
6.66
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.
3LM8_B_VIBB223_1
(THIAMINE
PYROPHOSPHOKINASE)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 7 LEU A 440
LEU A 375
SER A 259
THR A 265
 None
PC1  A 778 (-4.3A)
None
None
 1.07A 3lm8B-1bp1A:
undetectable
3lm8D-1bp1A:
undetectable		 3lm8B-1bp1A:
17.11
3lm8D-1bp1A:
17.11
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.
3TBG_A_RTZA1_1
(CYTOCHROME P450 2D6)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 LEU A1020
LEU A 604
GLN A 602
PHE A 597
SER A 606
 None
PC1  A1914 ( 4.3A)
None
None
None
 1.36A 3tbgA-5gjvA:
2.6		 3tbgA-5gjvA:
13.82
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.
3TBG_C_RTZC1_1
(CYTOCHROME P450 2D6)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 LEU A1020
LEU A 604
GLN A 602
PHE A 597
SER A 606
 None
PC1  A1914 ( 4.3A)
None
None
None
 1.34A 3tbgC-5gjvA:
2.6		 3tbgC-5gjvA:
13.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WG7_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 3wg7A-1qleA:
54.3
3wg7C-1qleA:
2.7
3wg7P-1qleA:
2.7		 3wg7A-1qleA:
53.19
3wg7C-1qleA:
20.59
3wg7P-1qleA:
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.
3WG7_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 3wg7C-1qleA:
2.7
3wg7N-1qleA:
54.3
3wg7P-1qleA:
2.7		 3wg7C-1qleA:
20.59
3wg7N-1qleA:
53.19
3wg7P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3X2Q_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 3x2qA-1qleA:
54.4
3x2qC-1qleA:
2.7
3x2qP-1qleA:
2.7		 3x2qA-1qleA:
53.19
3x2qC-1qleA:
20.59
3x2qP-1qleA:
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.
3X2Q_P_CHDP308_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 3x2qC-1qleA:
2.7
3x2qN-1qleA:
54.5
3x2qP-1qleA:
2.7		 3x2qC-1qleA:
20.59
3x2qN-1qleA:
53.19
3x2qP-1qleA:
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.
4DTA_A_ADNA401_1
(APH(2'')-ID)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		5 / 10 LYS A 420
PRO A 426
ILE A 205
ILE A 199
ASP A 200
 PC1  A 778 (-4.5A)
None
None
None
PC1  A 778 ( 4.6A)
 1.31A 4dtaA-1bp1A:
undetectable		 4dtaA-1bp1A:
19.74
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.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 6 PHE A 335
ASN A 264
ALA A 266
LEU A 276
 PC1  A 778 (-4.7A)
None
PC1  A 778 (-3.3A)
PC1  A 778 (-3.9A)
 1.01A 4ejgD-1bp1A:
undetectable		 4ejgD-1bp1A:
22.26
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.
4O8Z_A_BBIA402_1
(NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-3,
MITOCHONDRIAL)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 5 PHE A 425
PHE A 262
LEU A 333
PRO A 442
 PC1  A 778 (-4.7A)
None
None
None
 1.41A 4o8zA-1bp1A:
undetectable		 4o8zA-1bp1A:
21.32
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.
4RET_A_DGXA1107_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6a91 -
(-) 		5 / 12 LEU A1345
LEU A1055
GLY A1357
ALA A1329
ARG A1384
 None
PC1  A1609 ( 4.3A)
None
None
PC1  A1609 (-3.1A)
 1.18A 4retA-6a91A:
undetectable		 4retA-6a91A:
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6a91 -
(-) 		5 / 12 LEU A1345
LEU A1055
GLY A1357
ALA A1329
ARG A1384
 None
PC1  A1609 ( 4.3A)
None
None
PC1  A1609 (-3.1A)
 1.18A 4retC-6a91A:
2.9		 4retC-6a91A:
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.
4WCX_C_SAMC503_0
(BIOTIN AND THIAMIN
SYNTHESIS ASSOCIATED)		 4m4d LIPOPOLYSACCHARIDE-B
INDING PROTEIN
(Mus
musculus) 		5 / 12 TYR A 212
LEU A 144
PRO A 236
LEU A 101
ALA A  42
 PC1  A 506 (-3.7A)
None
None
None
PC1  A 506 (-3.6A)
 1.20A 4wcxC-4m4dA:
undetectable		 4wcxC-4m4dA:
21.42
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.
4XUC_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 ASN A 654
VAL A 655
GLY A 648
TYR A 650
ILE A 643
 None
None
None
PC1  A1906 ( 4.8A)
PC1  A1903 ( 4.5A)
 1.33A 4xucA-5gjvA:
undetectable		 4xucA-5gjvA:
7.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B1A_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.62A 5b1aA-1qleA:
54.4
5b1aC-1qleA:
2.7
5b1aP-1qleA:
2.7		 5b1aA-1qleA:
53.19
5b1aC-1qleA:
20.59
5b1aP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B1A_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 5b1aN-1qleA:
54.5
5b1aP-1qleA:
2.7		 5b1aN-1qleA:
53.19
5b1aP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B1B_C_CHDC307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 5b1bA-1qleA:
54.3
5b1bC-1qleA:
2.7
5b1bP-1qleA:
2.7		 5b1bA-1qleA:
53.19
5b1bC-1qleA:
20.59
5b1bP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B1B_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 5b1bN-1qleA:
54.3
5b1bP-1qleA:
2.7		 5b1bN-1qleA:
53.19
5b1bP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B3S_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.62A 5b3sA-1qleA:
54.5
5b3sC-1qleA:
2.7
5b3sP-1qleA:
2.7		 5b3sA-1qleA:
53.19
5b3sC-1qleA:
20.59
5b3sP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5B3S_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.52A 5b3sN-1qleA:
54.5
5b3sP-1qleA:
2.7		 5b3sN-1qleA:
53.19
5b3sP-1qleA:
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 8 ILE A   9
ALA A 451
VAL A 453
VAL A   7
 PC1  A 777 (-3.9A)
None
None
PC1  A 777 (-4.6A)
 0.89A 5ecnD-1bp1A:
1.9		 5ecnD-1bp1A:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5IY5_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 5iy5A-1qleA:
54.4
5iy5C-1qleA:
2.7		 5iy5A-1qleA:
53.19
5iy5C-1qleA:
20.37
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_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.55A 5iy5C-1qleA:
2.7
5iy5N-1qleA:
54.3
5iy5P-1qleA:
2.7		 5iy5C-1qleA:
20.37
5iy5N-1qleA:
53.19
5iy5P-1qleA:
20.37
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.
5KC0_A_RBFA303_2
(RIBOFLAVIN
TRANSPORTER RIBU)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		3 / 3 LYS A  77
LEU A 220
ILE A 130
 None
PC1  A 777 ( 4.7A)
None
 0.72A 5kc0A-1bp1A:
undetectable		 5kc0A-1bp1A:
19.81
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.
5LSA_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 ASN A 654
VAL A 655
GLY A 648
TYR A 650
ILE A 643
 None
None
None
PC1  A1906 ( 4.8A)
PC1  A1903 ( 4.5A)
 1.35A 5lsaA-5gjvA:
undetectable		 5lsaA-5gjvA:
7.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5W97_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 5w97A-1qleA:
54.1
5w97C-1qleA:
2.7
5w97c-1qleA:
2.7		 5w97A-1qleA:
53.19
5w97C-1qleA:
20.59
5w97c-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5WAU_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.54A 5wauA-1qleA:
54.5
5wauC-1qleA:
2.7
5wauc-1qleA:
2.7		 5wauA-1qleA:
53.19
5wauC-1qleA:
20.59
5wauc-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X19_C_CHDC305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 5x19A-1qleA:
54.2
5x19C-1qleA:
2.3
5x19P-1qleA:
2.7		 5x19A-1qleA:
53.19
5x19C-1qleA:
20.59
5x19P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X1F_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 5x1fN-1qleA:
54.2
5x1fP-1qleA:
2.6		 5x1fN-1qleA:
53.19
5x1fP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XDQ_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.62A 5xdqA-1qleA:
54.4
5xdqC-1qleA:
2.7
5xdqP-1qleA:
2.7		 5xdqA-1qleA:
53.19
5xdqC-1qleA:
20.59
5xdqP-1qleA:
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.
5XDQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 5xdqC-1qleA:
2.7
5xdqN-1qleA:
54.4
5xdqP-1qleA:
2.7		 5xdqC-1qleA:
20.59
5xdqN-1qleA:
53.19
5xdqP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XDX_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		5 / 9 HIS A 269
TRP A 323
MET A 332
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.64A 5xdxA-1qleA:
54.3
5xdxC-1qleA:
2.7
5xdxP-1qleA:
0.9		 5xdxA-1qleA:
53.19
5xdxC-1qleA:
19.01
5xdxP-1qleA:
19.01
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.
5XDX_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 5xdxC-1qleA:
2.7
5xdxN-1qleA:
54.3
5xdxP-1qleA:
2.7		 5xdxC-1qleA:
19.01
5xdxN-1qleA:
53.19
5xdxP-1qleA:
19.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z84_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 5z84A-1qleA:
54.5
5z84C-1qleA:
2.7
5z84P-1qleA:
2.7		 5z84A-1qleA:
53.19
5z84C-1qleA:
20.59
5z84P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z85_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 5z85A-1qleA:
54.5
5z85C-1qleA:
2.7
5z85P-1qleA:
2.7		 5z85A-1qleA:
53.19
5z85C-1qleA:
20.59
5z85P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z86_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 5z86A-1qleA:
54.5
5z86C-1qleA:
2.7
5z86P-1qleA:
2.7		 5z86A-1qleA:
53.19
5z86C-1qleA:
20.59
5z86P-1qleA:
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.
5Z86_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 5z86C-1qleA:
2.7
5z86N-1qleA:
54.5
5z86P-1qleA:
2.7		 5z86C-1qleA:
20.59
5z86N-1qleA:
53.19
5z86P-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ZCO_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 5zcoA-1qleA:
54.4
5zcoC-1qleA:
2.7
5zcoP-1qleA:
2.2		 5zcoA-1qleA:
53.19
5zcoC-1qleA:
20.59
5zcoP-1qleA:
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.
5ZCO_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.60A 5zcoC-1qleA:
2.7
5zcoN-1qleA:
54.5
5zcoP-1qleA:
2.2		 5zcoC-1qleA:
20.59
5zcoN-1qleA:
53.19
5zcoP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ZCP_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.56A 5zcpA-1qleA:
54.5
5zcpC-1qleA:
2.7
5zcpP-1qleA:
2.7		 5zcpA-1qleA:
53.19
5zcpC-1qleA:
20.59
5zcpP-1qleA:
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.
5ZCP_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.58A 5zcpC-1qleA:
2.7
5zcpN-1qleA:
54.5
5zcpP-1qleA:
2.7		 5zcpC-1qleA:
20.59
5zcpN-1qleA:
53.19
5zcpP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ZCQ_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 5zcqA-1qleA:
54.5
5zcqC-1qleA:
2.7
5zcqP-1qleA:
2.7		 5zcqA-1qleA:
53.19
5zcqC-1qleA:
20.59
5zcqP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ZCQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.59A 5zcqN-1qleA:
54.5
5zcqP-1qleA:
2.7		 5zcqN-1qleA:
53.19
5zcqP-1qleA:
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.
6AK3_A_P2EA1201_1
(PROSTAGLANDIN E2
RECEPTOR EP3
SUBTYPE,SOLUBLE
CYTOCHROME B562)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 4 PRO A 430
MET A 224
GLY A   4
VAL A   7
 PC1  A 777 (-4.7A)
None
None
PC1  A 777 (-4.6A)
 1.39A 6ak3A-1bp1A:
0.0		 6ak3A-1bp1A:
10.11
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.
6AK3_A_P2EA1201_1
(PROSTAGLANDIN E2
RECEPTOR EP3
SUBTYPE,SOLUBLE
CYTOCHROME B562)		 1bp1 BACTERICIDAL/PERMEAB
ILITY-INCREASING
PROTEIN
(Homo
sapiens) 		4 / 4 PRO A 430
MET A 224
GLY A 226
VAL A   7
 PC1  A 777 (-4.7A)
None
None
PC1  A 777 (-4.6A)
 1.48A 6ak3A-1bp1A:
0.0		 6ak3A-1bp1A:
10.11
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.
6MD4_A_BRLA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S
(Oryctolagus
cuniculus) 		5 / 12 GLY A 634
HIS A 274
LEU A 283
ILE A 639
MET A 620
 None
None
PC1  A1913 ( 4.7A)
PC1  A1903 ( 4.6A)
None
 1.41A 6md4A-5gjvA:
undetectable		 6md4A-5gjvA:
4.08
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_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 8 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.57A 6nknC-1qleA:
2.8
6nknN-1qleA:
53.9
6nknP-1qleA:
2.7		 6nknC-1qleA:
20.59
6nknN-1qleA:
53.19
6nknP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6NMF_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.62A 6nmfN-1qleA:
53.7
6nmfP-1qleA:
2.7		 6nmfN-1qleA:
53.19
6nmfP-1qleA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6NMP_P_CHDP302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III
(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		4 / 7 HIS A 269
TRP A 323
TYR A 339
TRP C 106
 PC1  C 301 ( 4.2A)
None
PC1  C 301 (-3.3A)
PC1  C 301 (-4.4A)
 0.61A 6nmpN-1qleA:
53.9
6nmpP-1qleA:
2.5		 6nmpN-1qleA:
53.19
6nmpP-1qleA:
20.59