SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1itk'

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)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		6 / 8 HIS A 259
GLY A 262
LYS A 263
MET A 367
LEU A 369
ASP A 372
 HEM  A 800 (-3.4A)
HEM  A 800 (-3.3A)
None
None
None
None
 0.44A 1aegA-1itkA:
32.5		 1aegA-1itkA:
18.28
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.
1K2S_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 TRP A 719
PHE A 715
GLU A 543
VAL A 464
 None
 1.43A 1k2sA-1itkA:
0.0
1k2sB-1itkA:
0.0		 1k2sA-1itkA:
20.69
1k2sB-1itkA:
20.69
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.
1N4F_A_ASRA140_0
(LYSOZYME C)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 ASN A 227
ALA A 232
ASN A 236
 None
None
CL  A2001 (-4.2A)
 0.79A 1n4fA-1itkA:
0.0		 1n4fA-1itkA:
9.64
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.
1S9P_A_DESA459_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 533
LEU A 536
ALA A 540
GLU A 543
ILE A 514
 None
 0.70A 1s9pA-1itkA:
undetectable		 1s9pA-1itkA:
14.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AYL_A_FLPA1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.08A 2aylA-1itkA:
0.0		 2aylA-1itkA:
21.09
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.
2BM9_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.96A 2bm9A-1itkA:
undetectable		 2bm9A-1itkA:
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.
2BM9_C_SAMC301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.87A 2bm9C-1itkA:
undetectable		 2bm9C-1itkA:
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.
2BM9_D_SAMD301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.97A 2bm9D-1itkA:
undetectable		 2bm9D-1itkA:
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.
2BM9_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.99A 2bm9E-1itkA:
undetectable		 2bm9E-1itkA:
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.
2BR4_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.94A 2br4A-1itkA:
undetectable		 2br4A-1itkA:
17.03
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.
2BR4_C_SAMC301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.92A 2br4C-1itkA:
undetectable		 2br4C-1itkA:
17.03
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.
2BR4_D_SAMD301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.95A 2br4D-1itkA:
undetectable		 2br4D-1itkA:
17.03
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.
2BR4_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 0.93A 2br4E-1itkA:
undetectable		 2br4E-1itkA:
17.03
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.
2BR4_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 458
GLY A 538
ALA A 467
ALA A 471
 None
 1.07A 2br4F-1itkA:
undetectable		 2br4F-1itkA:
17.03
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.
2EJ3_C_GBNC1414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 8 TYR A 381
ARG A 238
THR A 251
ALA A 252
ALA A 253
 None
 1.40A 2ej3C-1itkA:
undetectable		 2ej3C-1itkA:
19.70
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.
2HRE_D_CHDD702_0
(FERROCHELATASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 ARG A 102
GLY A 188
PRO A 189
 None
 0.68A 2hreD-1itkA:
0.0		 2hreD-1itkA:
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.
2OKC_A_SAMA500_1
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 THR A 642
ASP A 646
ASN A 650
ASP A 653
 None
 1.17A 2okcA-1itkA:
undetectable		 2okcA-1itkA:
21.84
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.
2QHF_A_ACTA503_0
(CHORISMATE SYNTHASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 GLN A 239
THR A 240
ARG A 243
ALA A 211
 SO4  A 732 (-4.0A)
None
SO4  A 732 (-3.9A)
None
 1.33A 2qhfA-1itkA:
0.0		 2qhfA-1itkA:
20.95
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 GLN A 115
THR A 304
TRP A  79
 None
HEM  A 800 (-3.4A)
None
 1.09A 2rctA-1itkA:
0.0		 2rctA-1itkA:
11.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X08_A_ASCA1253_0
(CYTOCHROME C
PEROXIDASE,
MITOCHONDRIAL)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 9 ALA A  81
ASP A  82
TYR A  86
PRO A  88
HIS A 265
 None
None
None
HEM  A 800 (-4.4A)
HEM  A 800 (-3.8A)
 0.74A 2x08A-1itkA:
32.7		 2x08A-1itkA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZIF_B_SAMB298_1
(PUTATIVE
MODIFICATION
METHYLASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 ASP A 582
THR A 506
GLU A 500
 CL  A2004 (-4.9A)
None
None
 0.83A 2zifB-1itkA:
undetectable		 2zifB-1itkA:
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.
3BJW_H_SVRH511_3
(PHOSPHOLIPASE A2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 VAL A 716
ILE A 624
GLY A 625
ARG A 585
 None
 0.83A 3bjwH-1itkA:
0.0		 3bjwH-1itkA:
8.59
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.
3BRF_A_SORA1_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 GLY A 113
ASP A 177
SER A 148
 None
 0.68A 3brfA-1itkA:
undetectable		 3brfA-1itkA:
20.57
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.
3JZJ_A_ACRA405_1
(ACARBOSE/MALTOSE
BINDING PROTEIN GACH)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 GLY A 109
ALA A 211
ASP A 105
GLY A 188
ARG A 198
 None
 1.31A 3jzjA-1itkA:
0.0		 3jzjA-1itkA:
19.57
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.
3K13_C_THHC643_1
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 ASN A 608
ASP A 605
ARG A 116
 None
 0.87A 3k13C-1itkA:
0.0		 3k13C-1itkA:
17.88
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)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 511
LEU A 504
SER A 529
GLY A 538
ALA A 467
 None
 1.03A 3kk6A-1itkA:
0.0		 3kk6A-1itkA:
21.09
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)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.13A 3kk6A-1itkA:
0.0		 3kk6A-1itkA:
21.09
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_B_CELB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
SER A 529
GLY A 538
 None
 1.03A 3kk6B-1itkA:
0.0		 3kk6B-1itkA:
21.09
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.
3KL3_A_DHIA403_0
(GLUCURONOXYLANASE
XYNC)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 4 GLY A 109
TYR A 101
GLY A 106
ASP A 478
 None
 1.14A 3kl3A-1itkA:
undetectable		 3kl3A-1itkA:
20.57
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.
3NT1_A_NPSA5_1
(PROSTAGLANDIN-ENDOPE
ROXIDE SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.05A 3nt1A-1itkA:
0.0		 3nt1A-1itkA:
22.05
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.
3NT1_B_NPSB4_1
(PROSTAGLANDIN-ENDOPE
ROXIDE SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.05A 3nt1B-1itkA:
0.0		 3nt1B-1itkA:
22.05
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.
3NXU_A_RITA600_2
(CYTOCHROME P450 3A4)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 ARG A 133
ILE A 120
THR A 407
THR A 304
 None
None
None
HEM  A 800 (-3.4A)
 1.01A 3nxuA-1itkA:
0.0		 3nxuA-1itkA:
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.
3R9S_A_BEZA264_0
(CARNITINYL-COA
DEHYDRATASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 ALA A 611
ILE A 698
GLU A 613
ALA A  40
 CL  A2002 ( 3.8A)
None
None
None
 0.82A 3r9sA-1itkA:
undetectable		 3r9sA-1itkA:
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.
3R9S_C_BEZC264_0
(CARNITINYL-COA
DEHYDRATASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 ALA A 611
ILE A 698
GLU A 613
ALA A  40
 CL  A2002 ( 3.8A)
None
None
None
 0.80A 3r9sC-1itkA:
undetectable		 3r9sC-1itkA:
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.
3RR3_C_FLRC700_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.07A 3rr3C-1itkA:
undetectable		 3rr3C-1itkA:
22.11
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.
3RR3_D_FLRD700_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.07A 3rr3D-1itkA:
0.0		 3rr3D-1itkA:
22.11
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.
3TM4_A_SAMA401_0
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 GLY A 583
TYR A 628
ALA A 469
ASN A 603
PRO A 579
 CL  A2004 (-4.1A)
None
None
CL  A2004 (-4.1A)
None
 1.06A 3tm4A-1itkA:
undetectable		 3tm4A-1itkA:
19.51
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.
3TM4_B_SAMB401_0
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 GLY A 583
TYR A 628
ALA A 469
ASN A 603
PRO A 579
 CL  A2004 (-4.1A)
None
None
CL  A2004 (-4.1A)
None
 1.07A 3tm4B-1itkA:
undetectable		 3tm4B-1itkA:
19.51
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.
3TZF_B_08DB280_1
(7,8-DIHYDROPTEROATE
SYNTHASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 8 THR A 593
ARG A 594
PRO A 595
SER A  29
 SO4  A 734 (-3.7A)
SO4  A 734 (-4.2A)
None
None
 1.09A 3tzfB-1itkA:
undetectable		 3tzfB-1itkA:
17.82
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.
3UA1_A_08YA600_1
(CYTOCHROME P450 3A4)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 ARG A 133
ILE A 120
THR A 407
ALA A 127
THR A 304
 None
None
None
None
HEM  A 800 (-3.4A)
 1.29A 3ua1A-1itkA:
0.0		 3ua1A-1itkA:
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.
3WIP_G_ACTG305_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 ASP A 476
ARG A 416
LYS A 479
 None
 1.26A 3wipG-1itkA:
undetectable		 3wipG-1itkA:
15.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WXO_A_NIZA802_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 8 TRP A  78
TRP A  79
LYS A 131
LEU A 288
ASN A 292
 None
 0.67A 3wxoA-1itkA:
60.5		 3wxoA-1itkA:
54.19
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.
4G24_A_ACAA1004_1
(PENTATRICOPEPTIDE
REPEAT-CONTAINING
PROTEIN AT2G32230,
MITOCHONDRIAL)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 ALA A 604
ASN A 603
LEU A 600
VAL A 599
 None
CL  A2004 (-4.1A)
None
SO4  A 734 ( 4.8A)
 1.04A 4g24A-1itkA:
0.0		 4g24A-1itkA:
21.24
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.
4K4Y_A_ACTA502_0
(RNA-DEPENDENT RNA
POLYMERASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 LYS A 405
LEU A 406
GLU A 250
LEU A 254
 None
None
None
HEM  A 800 (-4.1A)
 1.38A 4k4yA-1itkA:
0.0		 4k4yA-1itkA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K4Y_E_ACTE503_0
(RNA-DEPENDENT RNA
POLYMERASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 4 LYS A 405
LEU A 406
GLU A 250
LEU A 254
 None
None
None
HEM  A 800 (-4.1A)
 1.38A 4k4yE-1itkA:
0.0		 4k4yE-1itkA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 PRO A 315
GLY A 309
HIS A 265
ASP A  82
TYR A  83
 None
None
HEM  A 800 (-3.8A)
None
None
 1.21A 4lxzC-1itkA:
undetectable		 4lxzC-1itkA:
19.17
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.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 THR A 304
ARG A  92
TRP A  79
LEU A  89
 HEM  A 800 (-3.4A)
HEM  A 800 (-4.2A)
None
HEM  A 800 (-4.0A)
 1.39A 4nsbA-1itkA:
undetectable		 4nsbA-1itkA:
18.37
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.
4OKB_A_198A1002_2
(ANDROGEN RECEPTOR)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 LEU A 606
ASN A 603
LEU A 577
VAL A 498
 None
CL  A2004 (-4.1A)
None
None
 1.19A 4okbA-1itkA:
undetectable		 4okbA-1itkA:
16.08
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.
4OLT_A_GCSA301_1
(CHITOSANASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 4 ASP A 356
GLY A 309
PRO A 310
GLN A 342
 None
 1.42A 4oltA-1itkA:
0.0		 4oltA-1itkA:
18.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 6 ASP A  82
TYR A  86
LEU A  89
HIS A 265
THR A 304
 None
None
HEM  A 800 (-4.0A)
HEM  A 800 (-3.8A)
HEM  A 800 (-3.4A)
 0.33A 4paeA-1itkA:
59.6		 4paeA-1itkA:
54.05
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.
4QOI_B_ML1B303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 11 GLY A 258
GLY A 257
GLY A  87
ILE A 161
PHE A 166
 HEM  A 800 (-3.6A)
None
None
None
None
 0.78A 4qoiA-1itkA:
undetectable
4qoiB-1itkA:
undetectable		 4qoiA-1itkA:
16.33
4qoiB-1itkA:
16.33
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.
4U9U_B_ACTB1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 ARG A 409
GLY A  99
ALA A  98
GLY A 108
 None
None
None
CL  A2013 ( 3.7A)
 0.83A 4u9uB-1itkA:
undetectable		 4u9uB-1itkA:
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.
4V3W_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 VAL A 464
TRP A 719
PHE A 715
GLU A 543
 None
 1.41A 4v3wA-1itkA:
0.0
4v3wB-1itkA:
1.0		 4v3wA-1itkA:
22.22
4v3wB-1itkA:
22.22
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_E_SORE1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 7 ILE A 453
LEU A 463
GLU A 543
GLY A 538
GLY A 537
 None
 1.48A 5a06E-1itkA:
undetectable		 5a06E-1itkA:
19.89
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.
5AD4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 VAL A 464
TRP A 719
PHE A 715
GLU A 543
 None
 1.45A 5ad4A-1itkA:
0.0
5ad4B-1itkA:
1.0		 5ad4A-1itkA:
22.22
5ad4B-1itkA:
22.22
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.
5AD4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 TRP A 719
PHE A 715
GLU A 543
VAL A 464
 None
 1.43A 5ad4A-1itkA:
0.0
5ad4B-1itkA:
1.0		 5ad4A-1itkA:
22.22
5ad4B-1itkA:
22.22
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.
5AD8_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 TRP A 719
PHE A 715
GLU A 543
VAL A 464
 None
 1.47A 5ad8A-1itkA:
0.9
5ad8B-1itkA:
0.8		 5ad8A-1itkA:
22.22
5ad8B-1itkA:
22.22
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.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 LEU A 369
GLY A 306
THR A 195
ASN A 220
VAL A 219
 None
None
None
CL  A2014 ( 4.3A)
CL  A2001 ( 4.1A)
 1.38A 5d0yA-1itkA:
0.3		 5d0yA-1itkA:
12.23
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.
5DWK_C_ACTC207_0
(DIACYLGLYCEROL
KINASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 ALA A 340
GLU A 222
ASN A 220
GLU A 194
 None
None
CL  A2014 ( 4.3A)
None
 1.39A 5dwkC-1itkA:
undetectable		 5dwkC-1itkA:
9.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G08_A_Z80A1187_1
(FREQUENIN 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 PHE A 241
PHE A 395
THR A 260
TRP A 318
 HEM  A 800 ( 4.9A)
None
None
None
 1.05A 5g08A-1itkA:
0.0		 5g08A-1itkA:
13.95
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.
5GWK_F_EVPF102_1
(DNA TOPOISOMERASE
2-ALPHA)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 GLY A 482
ASP A 726
ARG A 561
MET A 621
 CL  A2012 ( 4.9A)
None
None
None
 1.09A 5gwkA-1itkA:
0.0		 5gwkA-1itkA:
21.15
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.
5HNZ_B_TA1B902_2
(TUBULIN BETA-2B
CHAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		3 / 3 LEU A 687
LEU A 651
ARG A 694
 None
 0.66A 5hnzB-1itkA:
undetectable		 5hnzB-1itkA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JVZ_A_FLPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.05A 5jvzA-1itkA:
1.1		 5jvzA-1itkA:
20.92
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.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 VAL A 507
LEU A 511
LEU A 504
GLY A 538
ALA A 467
 None
 1.05A 5jvzB-1itkA:
1.0		 5jvzB-1itkA:
20.92
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.
5M66_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 4 GLN A 364
THR A 365
GLU A 334
LEU A 369
 None
 1.39A 5m66A-1itkA:
undetectable		 5m66A-1itkA:
21.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5SYI_A_NIZA805_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 5 ARG A  92
TRP A  95
HIS A  96
PRO A 221
 HEM  A 800 (-4.2A)
HEM  A 800 (-3.5A)
None
HEM  A 800 (-4.3A)
 0.17A 5syiA-1itkA:
62.0		 5syiA-1itkA:
59.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5SYI_B_NIZB806_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 5 ARG A  92
TRP A  95
HIS A  96
PRO A 221
SER A 305
 HEM  A 800 (-4.2A)
HEM  A 800 (-3.5A)
None
HEM  A 800 (-4.3A)
HEM  A 800 (-2.7A)
 0.16A 5syiB-1itkA:
62.1		 5syiB-1itkA:
59.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5SYJ_A_NIZA810_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		6 / 6 ARG A  92
TRP A  95
HIS A  96
LEU A 216
PRO A 221
SER A 305
 HEM  A 800 (-4.2A)
HEM  A 800 (-3.5A)
None
None
HEM  A 800 (-4.3A)
HEM  A 800 (-2.7A)
 0.19A 5syjA-1itkA:
61.8		 5syjA-1itkA:
59.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5SYJ_B_NIZB810_1
(CATALASE-PEROXIDASE)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		6 / 6 ARG A  92
TRP A  95
HIS A  96
LEU A 216
PRO A 221
SER A 305
 HEM  A 800 (-4.2A)
HEM  A 800 (-3.5A)
None
None
HEM  A 800 (-4.3A)
HEM  A 800 (-2.7A)
 0.19A 5syjB-1itkA:
61.8		 5syjB-1itkA:
59.97
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.
5UNU_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 TRP A 719
PHE A 715
GLU A 543
VAL A 464
 None
 1.45A 5unuA-1itkA:
1.5
5unuB-1itkA:
0.8		 5unuA-1itkA:
22.22
5unuB-1itkA:
22.22
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.
5UNX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 VAL A 464
TRP A 719
PHE A 715
GLU A 543
 None
 1.50A 5unxA-1itkA:
2.1
5unxB-1itkA:
1.1		 5unxA-1itkA:
22.22
5unxB-1itkA:
22.22
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.
5UNX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 6 TRP A 719
PHE A 715
GLU A 543
VAL A 464
 None
 1.45A 5unxA-1itkA:
0.0
5unxB-1itkA:
1.0		 5unxA-1itkA:
22.22
5unxB-1itkA:
22.22
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)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		4 / 7 ARG A 133
ILE A 120
THR A 407
THR A 304
 None
None
None
HEM  A 800 (-3.4A)
 1.01A 5vc0A-1itkA:
0.0		 5vc0A-1itkA:
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.
6GNG_A_QPSA601_2
(-)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 GLY A 109
TYR A 218
VAL A 185
ARG A 409
GLY A 106
 None
 1.31A 6gngA-1itkA:
undetectable		 6gngA-1itkA:
23.00
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.
6GNG_A_QPSA601_2
(-)		 1itk CATALASE-PEROXIDASE
(Haloarcula
marismortui) 		5 / 12 GLY A 262
TYR A 322
VAL A 354
PRO A 366
GLY A 309
 HEM  A 800 (-3.3A)
None
None
None
None
 1.37A 6gngA-1itkA:
undetectable		 6gngA-1itkA:
23.00