SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'HEZ'


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.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		5 / 12 HIS A  40
PHE A 219
HIS A 151
ASP A  43
ASP A  42
 CD  A 301 ( 3.4A)
HEZ  A 315 ( 4.4A)
CD  A 301 ( 3.5A)
CD  A 301 ( 2.1A)
TAM  A 309 (-2.7A)
 1.04A 1a4lC-3wl4A:
undetectable		 1a4lC-3wl4A:
21.81
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.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.88A 1dhiA-4rv7A:
undetectable		 1dhiA-4rv7A:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.88A 1dhjA-4rv7A:
undetectable		 1dhjA-4rv7A:
23.15
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.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 ILE A  54
ALA A  82
GLN A   9
ILE A 117
LEU A 153
 None
None
HEZ  A1003 (-4.2A)
None
HEZ  A1003 (-4.9A)
 1.21A 1dlsA-4rv7A:
undetectable		 1dlsA-4rv7A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.86A 1draA-4rv7A:
undetectable		 1draA-4rv7A:
23.15
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.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.88A 1drbA-4rv7A:
undetectable		 1drbA-4rv7A:
23.15
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.
1JNN_H_ESTH350_1
(MONOCLONAL
ANTI-ESTRADIOL
17E12E5
IMMUNOGLOBULIN
GAMMA-1 CHAIN
MONOCLONAL
ANTI-ESTRADIOL
17E12E5
IMMUNOGLOBULIN KAPPA
CHAIN)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 10 LYS B   9
ASP B   7
LEU B 402
PHE B  14
TYR B  16
 None
None
None
None
HEZ  B 706 (-3.2A)
 1.49A 1jnnH-4hxeB:
0.0
1jnnL-4hxeB:
0.0		 1jnnH-4hxeB:
15.65
1jnnL-4hxeB:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JU6_A_LYAA317_1
(THYMIDYLATE SYNTHASE)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 11 ILE A  53
LEU A  74
GLY A  46
PHE A  49
ALA A 114
 HEZ  A 322 ( 4.9A)
None
HEZ  A 312 ( 3.8A)
HEZ  A 312 (-3.6A)
None
 1.39A 1ju6A-4m5bA:
undetectable		 1ju6A-4m5bA:
20.13
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.
1JU6_C_LYAC315_1
(THYMIDYLATE SYNTHASE)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 10 ILE A  53
LEU A  74
GLY A  46
PHE A  49
ALA A 114
 HEZ  A 322 ( 4.9A)
None
HEZ  A 312 ( 3.8A)
HEZ  A 312 (-3.6A)
None
 1.39A 1ju6C-4m5bA:
undetectable		 1ju6C-4m5bA:
20.13
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.
1KXH_A_ACRA598_1
(ALPHA-AMYLASE)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		5 / 12 HIS A 299
VAL A 254
GLY A 252
ASN A 282
ILE A 412
 None
HEZ  A 703 ( 4.5A)
None
None
None
 1.21A 1kxhA-5ya1A:
undetectable		 1kxhA-5ya1A:
11.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NV8_A_SAMA300_0
(HEMK PROTEIN)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		5 / 12 THR A 224
GLY A 260
GLY A 257
VAL A 452
ALA A 457
 None
None
HEZ  A 703 ( 4.2A)
None
None
 0.91A 1nv8A-5ya1A:
undetectable		 1nv8A-5ya1A:
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.
1P93_B_DEXB2999_1
(GLUCOCORTICOID
RECEPTOR)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		5 / 12 MET A  92
ASN A 189
GLY A 191
GLN A 141
LEU A 145
 HEZ  A 703 (-4.1A)
None
None
None
None
 1.45A 1p93B-5ya1A:
undetectable		 1p93B-5ya1A:
16.13
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.
1P93_C_DEXC3999_1
(GLUCOCORTICOID
RECEPTOR)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		5 / 12 MET A  92
ASN A 189
GLY A 191
GLN A 141
LEU A 145
 HEZ  A 703 (-4.1A)
None
None
None
None
 1.50A 1p93C-5ya1A:
undetectable		 1p93C-5ya1A:
16.13
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.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 11 ALA A  68
GLY A 203
GLU A 198
ILE A  53
VAL A 206
 None
HEZ  A 306 ( 4.0A)
None
HEZ  A 322 ( 4.9A)
None
 1.15A 1pg2A-4m5bA:
undetectable		 1pg2A-4m5bA:
16.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1R15_C_NCAC439_0
(ADP-RIBOSYL CYCLASE)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		3 / 3 TRP A 224
PHE A 219
TRP A 227
 None
HEZ  A 315 ( 4.4A)
HEZ  A 315 (-3.8A)
 1.19A 1r15C-3wl4A:
undetectable		 1r15C-3wl4A:
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.
1R15_F_NCAF469_0
(ADP-RIBOSYL CYCLASE)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		3 / 3 TRP A 224
PHE A 219
TRP A 227
 None
HEZ  A 315 ( 4.4A)
HEZ  A 315 (-3.8A)
 1.18A 1r15F-3wl4A:
undetectable		 1r15F-3wl4A:
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.
1R15_G_NCAG479_0
(ADP-RIBOSYL CYCLASE)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		3 / 3 TRP A 224
PHE A 219
TRP A 227
 None
HEZ  A 315 ( 4.4A)
HEZ  A 315 (-3.8A)
 1.19A 1r15G-3wl4A:
undetectable		 1r15G-3wl4A:
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.
1R15_H_NCAH489_0
(ADP-RIBOSYL CYCLASE)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		3 / 3 TRP A 224
PHE A 219
TRP A 227
 None
HEZ  A 315 ( 4.4A)
HEZ  A 315 (-3.8A)
 1.18A 1r15H-3wl4A:
undetectable		 1r15H-3wl4A:
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.
1R5L_A_VIVA301_0
(PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN))		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		5 / 12 ILE A 127
TRP A 142
ILE A 187
VAL A 184
ILE A  37
 None
None
HEZ  A 317 ( 4.3A)
HEZ  A 317 (-4.7A)
None
 1.14A 1r5lA-3wl4A:
undetectable		 1r5lA-3wl4A:
20.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SV9_A_DIFA701_1
(PHOSPHOLIPASE A2)		 1m8t PHOSPHOLIPASE A2
(Ophiophagus
hannah) 		4 / 8 LEU A   2
GLY A  30
HIS A  48
PHE A 106
 HEZ  A1002 (-4.0A)
CA  A1001 (-4.3A)
None
None
 0.69A 1sv9A-1m8tA:
18.1		 1sv9A-1m8tA:
40.94
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.
1TNL_A_TPAA900_1
(TRYPSIN)		 4q4y COXSACKIEVIRUS
CAPSID PROTEIN VP1
COXSACKIEVIRUS
CAPSID PROTEIN VP2
(Enterovirus
C) 		5 / 6 ASP 1 287
SER 2 141
VAL 1 234
GLY 1 283
GLY 1 285
 None
None
HEZ  15003 ( 4.7A)
None
None
 1.24A 1tnlA-4q4y1:
undetectable		 1tnlA-4q4y1:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1U70_A_MTXA187_1
(DIHYDROFOLATE
REDUCTASE)		 3put HYPOTHETICAL
CONSERVED PROTEIN
(Rhizobium
etli) 		5 / 12 ALA A  75
GLU A  59
PHE A  38
ASN A 145
LEU A 143
 None
HEZ  A 167 ( 4.3A)
HEZ  A 167 ( 4.2A)
None
HEZ  A 167 (-4.5A)
 1.35A 1u70A-3putA:
undetectable		 1u70A-3putA:
21.43
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.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 10 GLY B 386
GLY B 387
SER B 466
PHE B 507
HIS B 578
 HEZ  B 709 ( 4.0A)
HEZ  B 709 (-3.7A)
HEZ  B 709 (-2.4A)
HEZ  B 709 (-4.0A)
None
 1.11A 1w76B-4hxeB:
15.7		 1w76B-4hxeB:
23.40
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.
2A1H_A_GBNA502_1
(BRANCHED CHAIN
AMINOTRANSFERASE)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		4 / 8 GLY A 459
THR A 456
ALA A 455
VAL A 424
 None
HEZ  A 703 (-4.4A)
HEZ  A 703 (-3.7A)
None
 0.87A 2a1hA-5ya1A:
undetectable
2a1hB-5ya1A:
undetectable		 2a1hA-5ya1A:
13.26
2a1hB-5ya1A:
13.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2B17_A_DIFA701_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 1m8t PHOSPHOLIPASE A2
(Ophiophagus
hannah) 		5 / 10 LEU A   2
GLY A  30
HIS A  48
ASP A  49
PHE A 106
 HEZ  A1002 (-4.0A)
CA  A1001 (-4.3A)
None
CA  A1001 (-2.1A)
None
 0.63A 2b17A-1m8tA:
18.0		 2b17A-1m8tA:
40.94
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.
2BM9_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 12 LEU B 538
LEU B 476
GLY B 469
ASP B 546
CYH B 549
 None
None
None
None
HEZ  B 709 ( 3.8A)
 1.23A 2bm9B-4hxeB:
undetectable		 2bm9B-4hxeB:
15.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DPZ_A_TYLA2001_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 1m8t PHOSPHOLIPASE A2
(Ophiophagus
hannah) 		4 / 6 LEU A   2
HIS A  48
ASP A  49
TYR A  52
 HEZ  A1002 (-4.0A)
None
CA  A1001 (-2.1A)
None
 0.52A 2dpzA-1m8tA:
18.3		 2dpzA-1m8tA:
40.94
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.
2DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.86A 2drcA-4rv7A:
undetectable		 2drcA-4rv7A:
23.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2OTF_A_2TNA201_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 1m8t PHOSPHOLIPASE A2
(Ophiophagus
hannah) 		4 / 5 LEU A   2
SER A  23
GLY A  30
HIS A  48
 HEZ  A1002 (-4.0A)
None
CA  A1001 (-4.3A)
None
 0.48A 2otfA-1m8tA:
18.3		 2otfA-1m8tA:
40.94
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.
2OTV_A_NCAA1301_0
(CATIONIC TRYPSIN)		 4q4y COXSACKIEVIRUS
CAPSID PROTEIN VP1
COXSACKIEVIRUS
CAPSID PROTEIN VP2
(Enterovirus
C;
Enterovirus
C) 		5 / 6 ASP 1 287
SER 2 141
VAL 1 234
GLY 1 283
GLY 1 285
 None
None
HEZ  15003 ( 4.7A)
None
None
 1.20A 2otvA-4q4y1:
undetectable		 2otvA-4q4y1:
21.66
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.
2UVN_A_ECNA1409_1
(CYTOCHROME P450 130)		 6gb1 PEPTIDE 11
(synthetic
construct) 		5 / 12 LEU B  21
PRO B  38
PRO B  37
GLY B  30
GLY B  29
 None
HEZ  B 101 (-3.2A)
HEZ  B 101 (-4.6A)
None
AIB  B  27 ( 4.5A)
 1.02A 2uvnA-6gb1B:
undetectable		 2uvnA-6gb1B:
5.88
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.
3D4S_A_TIMA401_2
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		3 / 3 THR A  88
SER A 110
PHE A 119
 HEZ  A 309 ( 4.2A)
None
None
 0.87A 3d4sA-4m5bA:
undetectable		 3d4sA-4m5bA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 4rv7 DIADENYLATE CYCLASE
(Listeria
monocytogenes) 		5 / 12 LEU A  12
SER A  33
ILE A  32
LEU A  59
ILE A  81
 HEZ  A1003 ( 4.9A)
None
None
None
None
 0.86A 3drcA-4rv7A:
undetectable		 3drcA-4rv7A:
23.15
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.
3GAN_A_SVRA158_1
(UNCHARACTERIZED
PROTEIN AT3G22680)		 3tfo PUTATIVE
3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE
(Sinorhizobium
meliloti) 		5 / 11 ARG A  22
GLN A 220
VAL A 221
ILE A   9
ILE A  16
 None
HEZ  A 265 ( 3.8A)
HEZ  A 265 ( 4.9A)
None
None
 1.05A 3ganA-3tfoA:
undetectable		 3ganA-3tfoA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HS6_B_EPAB1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3e4w PUTATIVE
UNCHARACTERIZED
PROTEIN
(Mycobacterium
avium) 		5 / 12 GLY A  79
ASN A  66
GLY A  19
ALA A  26
GLY A  67
 None
None
None
HEM  A 501 (-3.4A)
HEZ  A1100 ( 3.7A)
 1.02A 3hs6B-3e4wA:
undetectable		 3hs6B-3e4wA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KVV_A_URFA254_1
(URIDINE
PHOSPHORYLASE)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		4 / 6 GLY A 146
MET A 187
ILE A 116
VAL A 120
 None
HEZ  A 302 ( 4.9A)
HEZ  A 313 (-4.7A)
HEZ  A 313 ( 4.2A)
 1.17A 3kvvA-4m5bA:
undetectable		 3kvvA-4m5bA:
23.62
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.
3LXI_A_CAMA423_0
(CYTOCHROME P450)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 10 THR A  77
LEU A  87
LEU A  74
GLY A  70
THR A 202
 HEZ  A 312 (-4.0A)
None
None
None
None
 1.32A 3lxiA-4m5bA:
undetectable		 3lxiA-4m5bA:
19.43
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.
3MG0_Y_BO2Y1403_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		6 / 12 ALA A 457
THR A 456
ALA A 455
VAL A  27
ALA A  89
ALA A 461
 None
HEZ  A 703 (-4.4A)
HEZ  A 703 (-3.7A)
None
None
None
 1.33A 3mg0Y-5ya1A:
undetectable
3mg0Z-5ya1A:
undetectable		 3mg0Y-5ya1A:
16.67
3mg0Z-5ya1A:
16.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3OSH_A_OINA5811_1
(PHOSPHOLIPASE A2
ISOFORM 3)		 1m8t PHOSPHOLIPASE A2
(Ophiophagus
hannah) 		5 / 9 LEU A   2
PHE A   5
ILE A   9
GLY A  30
HIS A  48
 HEZ  A1002 (-4.0A)
None
None
CA  A1001 (-4.3A)
None
 0.36A 3oshA-1m8tA:
22.8		 3oshA-1m8tA:
67.23
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.
3SM2_A_478A126_2
(GAG-PRO-POL
POLYPROTEIN)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 11 ALA A 155
ALA A  66
PRO A   4
TYR A   7
LEU A 158
 None
None
None
HEZ  A 311 (-3.6A)
None
 1.03A 3sm2B-4m5bA:
undetectable		 3sm2B-4m5bA:
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.
3V3O_B_T1CB405_1
(TETX2 PROTEIN)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 12 ASN B 473
GLY B 434
PRO B 388
GLY B 386
ASN B 414
 None
None
None
HEZ  B 709 ( 4.0A)
None
 1.11A 3v3oB-4hxeB:
undetectable		 3v3oB-4hxeB:
19.40
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.
4C9K_A_CAMA424_0
(CYTOCHROME P450)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 9 THR A  77
LEU A  87
LEU A  74
GLY A  70
THR A 202
 HEZ  A 312 (-4.0A)
None
None
None
None
 1.34A 4c9kA-4m5bA:
undetectable		 4c9kA-4m5bA:
19.43
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.
4C9K_B_CAMB424_0
(CYTOCHROME P450)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 9 THR A  77
LEU A  87
LEU A  74
GLY A  70
THR A 202
 HEZ  A 312 (-4.0A)
None
None
None
None
 1.34A 4c9kB-4m5bA:
undetectable		 4c9kB-4m5bA:
19.43
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.
4FGJ_A_1PQA303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 9 TRP A  81
GLY A 123
GLY A 121
PHE A 115
ILE A 116
 None
HEZ  A 313 ( 4.1A)
None
HEZ  A 313 ( 4.4A)
HEZ  A 313 (-4.7A)
 1.46A 4fgjA-4m5bA:
undetectable
4fgjB-4m5bA:
undetectable		 4fgjA-4m5bA:
24.18
4fgjB-4m5bA:
24.18
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.
4JLG_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 12 ILE A   3
ALA A 105
GLY A 102
ASN A 109
GLU A 157
 None
None
None
None
HEZ  A 301 (-4.8A)
 1.17A 4jlgA-4m5bA:
undetectable		 4jlgA-4m5bA:
22.43
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.
4MM6_A_29EA603_1
(TRANSPORTER)		 3put HYPOTHETICAL
CONSERVED PROTEIN
(Rhizobium
etli) 		5 / 12 ALA A  89
TYR A  88
TYR A  90
PHE A  11
SER A 100
 None
HEZ  A 167 (-4.5A)
None
None
None
 1.26A 4mm6A-3putA:
undetectable		 4mm6A-3putA:
14.84
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.
4R29_D_SAMD301_0
(UNCHARACTERIZED
PROTEIN)		 5jfy DEOXYCYTIDINE
DEAMINASE
(Brassica
oleracea) 		5 / 12 SER A 120
ILE A 135
ALA A 136
GLY A 138
PHE A 139
 None
HEZ  A 204 ( 3.9A)
None
None
None
 1.01A 4r29D-5jfyA:
undetectable		 4r29D-5jfyA:
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.
4UUU_A_SAMA1546_0
(CYSTATHIONINE
BETA-SYNTHASE)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 11 LEU B 427
ASP B 437
ALA B 426
ILE B 359
ASP B 360
 HEZ  B 705 ( 4.5A)
None
None
None
None
 1.29A 4uuuA-4hxeB:
undetectable
4uuuB-4hxeB:
undetectable		 4uuuA-4hxeB:
12.76
4uuuB-4hxeB:
12.76
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.
4UUU_B_SAMB1548_0
(CYSTATHIONINE
BETA-SYNTHASE)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		5 / 11 LEU B 427
ASP B 437
ALA B 426
ILE B 359
ASP B 360
 HEZ  B 705 ( 4.5A)
None
None
None
None
 1.26A 4uuuB-4hxeB:
undetectable		 4uuuB-4hxeB:
12.76
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.
4W5O_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 7 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.98A 4w5oA-3wl4A:
2.5		 4w5oA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4W5Q_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 6 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.88A 4w5qA-3wl4A:
3.1		 4w5qA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4W5T_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 6 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.82A 4w5tA-3wl4A:
2.5		 4w5tA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z4C_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 6 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.95A 4z4cA-3wl4A:
2.5		 4z4cA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z4D_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 6 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.93A 4z4dA-3wl4A:
2.9		 4z4dA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z4E_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 7 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.88A 4z4eA-3wl4A:
2.9		 4z4eA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z4G_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 7 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.95A 4z4gA-3wl4A:
2.3		 4z4gA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ALB_L_TIQL1210_2
(MEDI2452 LIGHT CHAIN)		 4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594
(Pyrococcus
horikoshii) 		4 / 8 TYR B 247
GLY B 233
TYR B 239
PHE B 219
 None
None
HEZ  B 705 (-4.5A)
None
 0.87A 5albL-4hxeB:
undetectable		 5albL-4hxeB:
15.43
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.
5DZK_U_BEZU801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		4 / 6 PHE A 111
SER A  84
ALA A 114
LEU A  24
 None
None
None
HEZ  A 309 ( 4.2A)
 1.10A 5dzkg-4m5bA:
undetectable
5dzku-4m5bA:
undetectable		 5dzkg-4m5bA:
22.22
5dzku-4m5bA:
2.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5H4D_A_BBIA403_1
(NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-3,
MITOCHONDRIAL)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		4 / 6 ARG A  25
PHE A  29
GLU A 454
VAL A 452
 None
None
HEZ  A 703 (-4.3A)
None
 1.26A 5h4dA-5ya1A:
undetectable		 5h4dA-5ya1A:
15.59
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.
5HKG_A_RAPA201_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1B)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		5 / 12 PHE A  28
VAL A 252
ILE A 187
PHE A 186
ILE A  37
 None
None
HEZ  A 317 ( 4.3A)
None
None
 1.18A 5hkgA-3wl4A:
undetectable		 5hkgA-3wl4A:
16.10
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.
5LBT_A_6T0A303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4m5b COBALAMIN
BIOSYNTHESIS PROTEIN
CBIM
(Caldanaerobacter
subterraneus) 		5 / 10 PHE A 188
ILE A  60
GLY A 195
TYR A 144
ASN A 148
 None
None
None
HEZ  A 305 (-3.7A)
None
 1.37A 5lbtA-4m5bA:
undetectable
5lbtB-4m5bA:
undetectable		 5lbtA-4m5bA:
23.40
5lbtB-4m5bA:
23.40
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.
5Y2O_A_8N6A501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3put HYPOTHETICAL
CONSERVED PROTEIN
(Rhizobium
etli) 		5 / 12 PHE A  25
LEU A 143
PHE A 108
MET A 117
TYR A  77
 None
HEZ  A 167 (-4.5A)
None
None
None
 1.19A 5y2oA-3putA:
undetectable		 5y2oA-3putA:
22.64
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.
6CBD_A_TRPA903_0
(PROTEIN ARGONAUTE-2)		 3wl4 UNCHARACTERIZED
PROTEIN
(Pyrococcus
furiosus) 		4 / 6 ILE A 223
GLN A 218
ILE A  46
ASP A  43
 HEZ  A 315 ( 4.3A)
TAM  A 309 ( 4.0A)
TAM  A 309 (-4.9A)
CD  A 301 ( 2.1A)
 0.81A 6cbdA-3wl4A:
2.2		 6cbdA-3wl4A:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 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)		 5ya1 AUTOINDUCER-2 KINASE
(Escherichia
coli) 		5 / 12 LEU A 272
GLY A 429
GLY A 427
ILE A 449
LEU A 439
 HEZ  A 703 ( 4.3A)
ATP  A 701 ( 3.8A)
None
None
None
 1.02A 6ectA-5ya1A:
undetectable		 6ectA-5ya1A:
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.
6GQI_A_ACTA604_0
(CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE)		 1jmt SPLICING FACTOR U2AF
35 KDA SUBUNIT
SPLICING FACTOR U2AF
65 KDA SUBUNIT
(Homo
sapiens;
Homo
sapiens) 		4 / 6 PRO B  95
TRP A 134
ILE B 102
GLY B  98
 None
None
HEZ  B 201 ( 4.7A)
None
 1.14A 6gqiA-1jmtB:
undetectable		 6gqiA-1jmtB:
3.88