SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5whs'

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.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		6 / 8 HIS A 279
GLY A 282
LYS A 283
THR A 284
LEU A 386
ASP A 389
 HEM  A 800 (-2.9A)
HEM  A 800 (-3.6A)
None
HEM  A 800 (-3.6A)
None
None
 0.59A 1aegA-5whsA:
31.9		 1aegA-5whsA:
16.29
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.
1EJ0_A_SAMA301_1
(FTSJ)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		3 / 3 ASP A 664
ASP A 657
ASP A 683
 None
 0.78A 1ej0A-5whsA:
undetectable		 1ej0A-5whsA:
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.
1I9G_A_SAMA301_0
(HYPOTHETICAL PROTEIN
RV2118C)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 GLY A 108
ALA A 113
LEU A 115
ASP A 146
LEU A 149
 None
 1.09A 1i9gA-5whsA:
undetectable		 1i9gA-5whsA:
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.
1JOM_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 11 ALA A 702
GLU A 608
PHE A 700
ILE A 612
LEU A 625
 None
 1.15A 1jomA-5whsA:
undetectable		 1jomA-5whsA:
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.
1SKX_A_RFPA1_2
(ORPHAN NUCLEAR
RECEPTOR PXR)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 PHE A 726
LEU A 618
MET A 734
LEU A 480
 None
 1.48A 1skxA-5whsA:
undetectable		 1skxA-5whsA:
15.96
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_B_CHDB4085_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE II
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIA-HEART)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 11 GLY A  83
THR A 333
THR A 331
PHE A 161
GLY A 277
 HEM  A 800 (-3.7A)
None
None
None
None
 1.48A 1v54A-5whsA:
0.1
1v54B-5whsA:
undetectable
1v54T-5whsA:
undetectable		 1v54A-5whsA:
undetectable
1v54B-5whsA:
undetectable
1v54T-5whsA:
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.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 PHE A 700
GLY A 630
GLY A 631
LEU A 635
LEU A 625
 None
 1.34A 1ya4B-5whsA:
undetectable		 1ya4B-5whsA:
9.02
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)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 4 VAL A 634
LEU A 706
ILE A 699
LEU A 611
 None
 0.98A 2byoA-5whsA:
undetectable		 2byoA-5whsA:
16.00
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.
2J2P_E_SC2E1289_1
(FICOLIN-2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 6 ASP A 100
ARG A 102
ASP A 177
ASP A 613
 None
 1.07A 2j2pE-5whsA:
undetectable
2j2pF-5whsA:
undetectable		 2j2pE-5whsA:
23.18
2j2pF-5whsA:
23.18
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.
2NNH_B_9CRB502_1
(CYTOCHROME P450 2C8)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 SER A 486
ILE A 505
ILE A 550
LEU A 525
ASN A 516
 None
 1.25A 2nnhB-5whsA:
undetectable		 2nnhB-5whsA:
9.65
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.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 GLU A 242
PRO A 248
ILE A 247
GLY A 243
 None
 1.11A 2qeuA-5whsA:
undetectable
2qeuC-5whsA:
1.9		 2qeuA-5whsA:
undetectable
2qeuC-5whsA:
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.
2WEY_A_EV1A1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 LEU A 635
LEU A 558
VAL A 566
GLU A 719
PHE A 722
 None
 1.14A 2weyA-5whsA:
undetectable		 2weyA-5whsA:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YVL_C_SAMC604_1
(HYPOTHETICAL PROTEIN)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 4 GLY A 106
GLU A 107
ASP A 495
TYR A  96
 None
 1.49A 2yvlC-5whsA:
undetectable		 2yvlC-5whsA:
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.
2ZXW_B_CHDB1086_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 6A2
CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 11 GLY A  83
THR A 333
THR A 331
PHE A 161
GLY A 277
 HEM  A 800 (-3.7A)
None
None
None
None
 1.45A 2zxwA-5whsA:
0.8
2zxwB-5whsA:
undetectable
2zxwT-5whsA:
undetectable		 2zxwA-5whsA:
undetectable
2zxwB-5whsA:
undetectable
2zxwT-5whsA:
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.
3D4S_A_TIMA401_1
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 THR A 388
ASP A 389
VAL A 328
SER A 324
TYR A 341
 HEM  A 800 ( 4.0A)
None
None
HEM  A 800 (-2.9A)
None
 1.32A 3d4sA-5whsA:
undetectable		 3d4sA-5whsA:
10.62
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.
3FL9_A_TOPA200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 LEU A 480
VAL A 531
ALA A 484
ILE A 550
LEU A 546
 None
 0.98A 3fl9A-5whsA:
undetectable		 3fl9A-5whsA:
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.
3FL9_F_TOPF200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 LEU A 480
VAL A 531
ALA A 484
ILE A 550
LEU A 546
 None
 1.00A 3fl9F-5whsA:
undetectable		 3fl9F-5whsA:
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.
3KK6_A_CELA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 LEU A 528
LEU A 521
SER A 545
GLY A 554
ALA A 484
 None
 1.07A 3kk6A-5whsA:
undetectable		 3kk6A-5whsA:
8.67
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.
3LN1_D_CELD682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 ARG A 606
LEU A 706
ARG A  27
ILE A  30
 None
 1.28A 3ln1D-5whsA:
0.6		 3ln1D-5whsA:
9.50
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.
3ONN_A_ACTA270_0
(PROTEIN SSM1)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 LEU A 236
SER A 231
ARG A 194
PRO A 119
 None
 1.36A 3onnA-5whsA:
undetectable		 3onnA-5whsA:
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.
3P2K_C_SAMC6735_1
(16S RRNA METHYLASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 ASN A 516
GLU A 677
THR A 607
SER A 486
 None
 1.34A 3p2kC-5whsA:
undetectable		 3p2kC-5whsA:
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.
3PGH_B_FLPB701_1
(CYCLOOXYGENASE-2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 11 VAL A 524
LEU A 528
LEU A 521
GLY A 554
ALA A 484
 None
 1.17A 3pghB-5whsA:
undetectable		 3pghB-5whsA:
9.50
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.
3RR3_C_FLRC700_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 VAL A 524
LEU A 528
LEU A 521
GLY A 554
ALA A 484
 None
 1.13A 3rr3C-5whsA:
undetectable		 3rr3C-5whsA:
9.50
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.
3UJ6_A_SAMA300_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 ILE A 550
GLY A 499
ILE A 505
ARG A 738
LEU A 618
 None
 0.87A 3uj6A-5whsA:
undetectable		 3uj6A-5whsA:
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.
4KQ8_A_ASDA602_1
(CYTOCHROME P450 19A1)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 ILE A 629
ILE A 699
ALA A 696
THR A 694
LEU A 647
 None
 1.21A 4kq8A-5whsA:
undetectable		 4kq8A-5whsA:
10.20
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.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 LEU A 564
ASP A 725
GLU A 719
VAL A 634
 None
 1.19A 4nkvA-5whsA:
undetectable		 4nkvA-5whsA:
9.96
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.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 6 ASP A  77
TYR A  81
LEU A  84
HIS A 285
THR A 323
 None
None
HEM  A 800 (-4.2A)
HEM  A 800 (-3.9A)
HEM  A 800 (-3.6A)
 0.31A 4paeA-5whsA:
60.7		 4paeA-5whsA:
6.34
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.
4XEY_A_1N1A601_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		3 / 3 MET A 394
ASP A 349
PHE A 348
 None
 0.89A 4xeyA-5whsA:
undetectable		 4xeyA-5whsA:
12.34
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.
4XEY_B_1N1B601_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		3 / 3 MET A 394
ASP A 349
PHE A 348
 None
 0.87A 4xeyB-5whsA:
undetectable		 4xeyB-5whsA:
12.34
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.
4ZVC_A_BEZA301_0
(DIGUANYLATE CYCLASE
DOSC)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 8 ILE A 505
LEU A 521
ILE A 550
LEU A 546
 None
 0.78A 4zvcA-5whsA:
undetectable
4zvcB-5whsA:
undetectable		 4zvcA-5whsA:
undetectable
4zvcB-5whsA:
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.
4ZVC_A_BEZA301_0
(DIGUANYLATE CYCLASE
DOSC)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 8 ILE A 550
LEU A 546
ILE A 505
LEU A 521
 None
 0.78A 4zvcA-5whsA:
undetectable
4zvcB-5whsA:
undetectable		 4zvcA-5whsA:
undetectable
4zvcB-5whsA:
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.
5A06_D_SORD1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 6 GLU A 107
GLY A 105
GLY A 104
ASP A 427
 None
 0.81A 5a06D-5whsA:
undetectable		 5a06D-5whsA:
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.
5BMV_C_VLBC507_1
(TUBULIN BETA CHAIN
TUBULIN ALPHA-1B
CHAIN)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 6 ASP A 395
TYR A 405
TYR A 346
LEU A 342
 None
 1.37A 5bmvB-5whsA:
undetectable		 5bmvB-5whsA:
11.40
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.
5IEP_A_VDYA201_1
(CDL2.3B)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 PHE A 722
LEU A 632
PHE A 659
PHE A 700
LEU A 611
 None
 1.21A 5iepA-5whsA:
undetectable		 5iepA-5whsA:
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.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 VAL A 524
LEU A 528
LEU A 521
GLY A 554
ALA A 484
 None
 1.10A 5jvzB-5whsA:
undetectable		 5jvzB-5whsA:
10.08
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.
5KSG_B_NIZB809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.47A 5ksgB-5whsA:
67.4		 5ksgB-5whsA:
5.67
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.
5KSN_A_NIZA809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.47A 5ksnA-5whsA:
67.4		 5ksnA-5whsA:
5.67
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.
5KSN_B_NIZB809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.49A 5ksnB-5whsA:
67.3		 5ksnB-5whsA:
5.67
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.
5KT8_B_NIZB809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.47A 5kt8B-5whsA:
67.3		 5kt8B-5whsA:
5.67
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.
5OTR_A_ACTA402_0
(CASEIN KINASE II
SUBUNIT ALPHA)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 VAL A 251
ASP A 395
PRO A 396
ALA A 254
 None
 1.06A 5otrA-5whsA:
undetectable		 5otrA-5whsA:
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.
5SXQ_B_NIZB808_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		6 / 8 ARG A 102
GLU A 107
VAL A 180
GLY A 493
LEU A 617
THR A 619
 None
 0.54A 5sxqB-5whsA:
67.3		 5sxqB-5whsA:
5.67
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.
5SXS_B_NIZB806_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.48A 5sxsB-5whsA:
67.4		 5sxsB-5whsA:
5.67
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.
5SYI_B_NIZB805_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.47A 5syiB-5whsA:
67.3		 5syiB-5whsA:
5.67
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.
5SYI_B_NIZB806_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		4 / 5 ARG A  87
HIS A  91
PRO A 241
SER A 324
 HEM  A 800 (-4.7A)
TOX  A  90 ( 3.8A)
HEM  A 800 ( 4.2A)
HEM  A 800 (-2.9A)
 0.39A 5syiB-5whsA:
67.3		 5syiB-5whsA:
5.67
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.
5SYJ_A_NIZA809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		6 / 8 ARG A 102
GLU A 107
VAL A 180
GLY A 493
LEU A 617
THR A 619
 None
 0.51A 5syjA-5whsA:
67.2		 5syjA-5whsA:
5.67
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.
5SYJ_A_NIZA810_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 6 ARG A  87
HIS A  91
LEU A 236
PRO A 241
SER A 324
 HEM  A 800 (-4.7A)
TOX  A  90 ( 3.8A)
None
HEM  A 800 ( 4.2A)
HEM  A 800 (-2.9A)
 0.34A 5syjA-5whsA:
67.2		 5syjA-5whsA:
5.67
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.
5SYJ_B_NIZB810_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 6 ARG A  87
HIS A  91
LEU A 236
PRO A 241
SER A 324
 HEM  A 800 (-4.7A)
TOX  A  90 ( 3.8A)
None
HEM  A 800 ( 4.2A)
HEM  A 800 (-2.9A)
 0.34A 5syjB-5whsA:
67.1		 5syjB-5whsA:
5.67
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_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 GLY A  83
THR A 333
THR A 331
PHE A 161
GLY A 277
 HEM  A 800 (-3.7A)
None
None
None
None
 1.48A 5x1bA-5whsA:
0.3
5x1bB-5whsA:
undetectable
5x1bT-5whsA:
undetectable		 5x1bA-5whsA:
undetectable
5x1bB-5whsA:
undetectable
5x1bT-5whsA:
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.
5XDQ_B_CHDB304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 11 GLY A  83
THR A 333
THR A 331
PHE A 161
GLY A 277
 HEM  A 800 (-3.7A)
None
None
None
None
 1.50A 5xdqA-5whsA:
1.1
5xdqB-5whsA:
undetectable
5xdqT-5whsA:
undetectable		 5xdqA-5whsA:
undetectable
5xdqB-5whsA:
undetectable
5xdqT-5whsA:
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.
5XDQ_G_CHDG102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 PHE A 161
GLY A 277
GLY A  83
THR A 333
THR A 331
 None
None
HEM  A 800 (-3.7A)
None
None
 1.47A 5xdqG-5whsA:
undetectable
5xdqN-5whsA:
0.4
5xdqO-5whsA:
undetectable		 5xdqG-5whsA:
undetectable
5xdqN-5whsA:
undetectable
5xdqO-5whsA:
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.
5XDX_O_CHDO301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 10 PHE A 161
GLY A 277
GLY A  83
THR A 333
THR A 331
 None
None
HEM  A 800 (-3.7A)
None
None
 1.49A 5xdxG-5whsA:
undetectable
5xdxN-5whsA:
0.1
5xdxO-5whsA:
undetectable		 5xdxG-5whsA:
undetectable
5xdxN-5whsA:
undetectable
5xdxO-5whsA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6CDQ_A_NIZA809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.48A 6cdqA-5whsA:
67.0		 6cdqA-5whsA:
38.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6CDQ_B_NIZB808_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.51A 6cdqB-5whsA:
66.9		 6cdqB-5whsA:
38.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6CFQ_B_NIZB809_1
(CATALASE-PEROXIDASE)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		7 / 9 ARG A 102
GLU A 107
VAL A 180
GLY A 493
SER A 494
LEU A 617
THR A 619
 None
 0.48A 6cfqB-5whsA:
67.3		 6cfqB-5whsA:
38.10
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.
6ECT_A_SAMA1300_0
(STIE PROTEIN)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 LEU A 148
GLY A 106
GLY A 108
ASP A 172
LEU A 424
 None
 1.06A 6ectA-5whsA:
undetectable		 6ectA-5whsA:
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.
6GNG_A_QPSA601_2
(-)		 5whs CATALASE-PEROXIDASE
(Neurospora
crassa) 		5 / 12 GLY A 104
TYR A 238
VAL A 180
ARG A 426
GLY A 101
 None
TOX  A  90 ( 2.8A)
None
None
None
 1.40A 6gngA-5whsA:
undetectable		 6gngA-5whsA:
12.45