SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2can'

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)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 8 GLY A 297
GLY A  91
LEU A  70
ASP A  80
 None
 0.81A 1aegA-2canA:
undetectable		 1aegA-2canA:
24.94
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.
1JGL_L_ESTL911_1
(IG GAMMA-1-CHAIN
IG KAPPA-CHAIN)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 10 TRP A  71
GLY A  75
LEU A  62
TYR A  78
HIS A  92
 None
 1.38A 1jglH-2canA:
undetectable
1jglL-2canA:
undetectable		 1jglH-2canA:
20.16
1jglL-2canA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LIK_A_ADNA699_1
(ADENOSINE KINASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 12 LEU A 305
GLY A 324
GLY A 325
ASN A 326
TYR A 123
 None
 1.07A 1likA-2canA:
undetectable		 1likA-2canA:
23.13
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.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 11 LEU A 290
PHE A 131
GLY A 268
LEU A 418
LEU A 294
 None
 1.16A 1mx1A-2canA:
undetectable		 1mx1A-2canA:
22.57
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.
1MZ9_D_VDYD1001_3
(CARTILAGE OLIGOMERIC
MATRIX PROTEIN)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		3 / 3 THR A 272
LEU A 377
LEU A  82
 None
 0.51A 1mz9C-2canA:
undetectable		 1mz9C-2canA:
8.40
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.
2JFA_B_CCSB417_0
(ESTROGEN RECEPTOR)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		3 / 3 GLN A  90
LYS A  96
VAL A  98
 None
 0.92A 2jfaB-2canA:
undetectable		 2jfaB-2canA:
18.89
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.
2JST_A_HLTA101_1
(FOUR-ALPHA-HELIX
BUNDLE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 5 ALA A 225
TRP A 156
LEU A 152
ALA A 226
 None
 1.07A 2jstA-2canA:
undetectable
2jstB-2canA:
undetectable		 2jstA-2canA:
10.00
2jstB-2canA:
10.00
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.
2PNJ_B_CHDB502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 7 MET A 228
ARG A 180
PRO A 231
GLY A 234
 None
CAN  A   1 (-4.2A)
None
None
 1.23A 2pnjB-2canA:
3.5		 2pnjB-2canA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q72_A_IXXA801_1
(TRANSPORTER)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 11 LEU A 360
LEU A 363
VAL A 367
ILE A 432
LEU A 397
 None
 1.19A 2q72A-2canA:
undetectable		 2q72A-2canA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEI_A_CXXA801_1
(TRANSPORTER)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 11 LEU A 360
LEU A 363
VAL A 367
ILE A 432
LEU A 397
 None
 1.19A 2qeiA-2canA:
undetectable		 2qeiA-2canA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XF3_A_J01A500_1
(ORF12)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 10 VAL A 238
ILE A 232
LEU A 418
GLY A 273
ALA A 349
 None
 1.12A 2xf3A-2canA:
undetectable		 2xf3A-2canA:
23.51
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.
2XF3_B_J01B500_1
(ORF12)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 9 VAL A 238
ILE A 232
LEU A 418
GLY A 273
ALA A 349
 None
 1.12A 2xf3B-2canA:
0.0		 2xf3B-2canA:
23.51
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.
2XFS_B_J01B500_1
(ORF12)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 9 VAL A 238
ILE A 232
LEU A 418
GLY A 273
ALA A 349
 None
 1.12A 2xfsB-2canA:
0.0		 2xfsB-2canA:
23.51
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.
2XH9_B_J01B1436_1
(ORF12)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 9 VAL A 238
ILE A 232
LEU A 418
GLY A 273
ALA A 349
 None
 1.14A 2xh9B-2canA:
0.0		 2xh9B-2canA:
23.51
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.
3AQI_A_CHDA2_0
(FERROCHELATASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 6 MET A 228
ARG A 180
PRO A 231
GLY A 234
 None
CAN  A   1 (-4.2A)
None
None
 1.26A 3aqiA-2canA:
3.4		 3aqiA-2canA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OHT_B_1N1B2000_1
(P38A)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 10 ILE A 411
ILE A 432
ILE A 429
ASN A 378
VAL A 238
 None
 1.26A 3ohtA-2canA:
undetectable
3ohtB-2canA:
undetectable		 3ohtA-2canA:
22.05
3ohtB-2canA:
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.
3P6G_A_IZPA133_1
(FATTY ACID-BINDING
PROTEIN, ADIPOCYTE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 12 PHE A  44
VAL A  73
PRO A  57
ASP A  72
ARG A  76
 None
 1.38A 3p6gA-2canA:
undetectable		 3p6gA-2canA:
17.39
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 12 LEU A 402
ILE A 432
ALA A 390
GLY A 409
ALA A 404
 None
 1.01A 4enhA-2canA:
undetectable		 4enhA-2canA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KJJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 12 ILE A 432
ALA A 415
ILE A 355
LEU A 425
ILE A 429
 None
 0.98A 4kjjA-2canA:
undetectable		 4kjjA-2canA:
17.81
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.
4L78_A_ACTA1327_0
(PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 4 VAL A 136
THR A 128
GLU A 124
GLU A 125
 None
 1.39A 4l78A-2canA:
1.6		 4l78A-2canA:
15.81
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.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		4 / 7 SER A  40
PHE A  44
HIS A  56
TYR A  78
 None
 1.40A 5dlvB-2canA:
1.2		 5dlvB-2canA:
19.15
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.
5FCT_B_C2FB402_1
(THYMIDYLATE SYNTHASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		3 / 3 ASN A 378
ASP A 350
GLY A 273
 None
 0.61A 5fctB-2canA:
undetectable		 5fctB-2canA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GWZ_D_010D6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
PEDV MAIN PROTEASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		3 / 3 MET A 139
HIS A 319
GLY A 146
 None
 0.68A 5gwzB-2canA:
undetectable		 5gwzB-2canA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_C_ACRC608_1
(ALPHA-AMYLASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		3 / 3 TYR A 126
ALA A 303
LEU A 290
 None
 0.70A 6ag0C-2canA:
2.2		 6ag0C-2canA:
12.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6R2E_F_FFOF403_0
(THYMIDYLATE SYNTHASE)		 2can ORNITHINE
AMINOTRANSFERASE
(Homo
sapiens) 		5 / 11 ILE A 420
ASN A  89
GLY A 353
ASN A 378
ALA A 346
 None
 1.29A 6r2eF-2canA:
undetectable		 6r2eF-2canA:
23.52