SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3agr'

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.
2IVU_A_ZD6A3015_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ALA A 165
GLY A 255
SER A 299
 None
 0.51A 2ivuA-3agrA:
undetectable		 2ivuA-3agrA:
18.35
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.
2IVU_A_ZD6A3015_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ALA A 165
GLY A 304
SER A 299
 None
 0.60A 2ivuA-3agrA:
undetectable		 2ivuA-3agrA:
18.35
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.
2PRG_A_BRLA1_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ILE A 261
ILE A 465
LEU A 280
 None
 0.56A 2prgA-3agrA:
undetectable		 2prgA-3agrA:
18.76
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.
2X9G_A_LYAA1270_2
(PTERIDINE REDUCTASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 MET A 301
VAL A 262
GLU A 441
 None
 0.82A 2x9gA-3agrA:
undetectable		 2x9gA-3agrA:
19.90
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 10 GLU A 211
GLY A 573
ALA A 570
LEU A 580
ARG A 582
 None
 1.29A 3a3yA-3agrA:
undetectable		 3a3yA-3agrA:
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.
3JUS_B_ECLB600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 LEU A 584
GLY A 590
ALA A 593
ILE A  42
 None
 0.81A 3jusB-3agrA:
undetectable		 3jusB-3agrA:
21.36
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.
3LM8_A_VIBA223_1
(THIAMINE
PYROPHOSPHOKINASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 7 LEU A 271
LEU A 265
SER A 297
ASP A 294
 None
 1.00A 3lm8A-3agrA:
undetectable
3lm8C-3agrA:
undetectable		 3lm8A-3agrA:
16.89
3lm8C-3agrA:
16.89
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.
3LM8_C_VIBC223_1
(THIAMINE
PYROPHOSPHOKINASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 ASP A 294
LEU A 271
LEU A 265
SER A 297
 None
 0.92A 3lm8A-3agrA:
undetectable
3lm8C-3agrA:
undetectable		 3lm8A-3agrA:
16.89
3lm8C-3agrA:
16.89
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.
3LM8_D_VIBD223_1
(THIAMINE
PYROPHOSPHOKINASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 ASP A 294
LEU A 271
LEU A 265
SER A 297
 None
 0.96A 3lm8B-3agrA:
undetectable
3lm8D-3agrA:
undetectable		 3lm8B-3agrA:
16.89
3lm8D-3agrA:
16.89
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.
3NY4_A_SMXA310_1
(BETA-LACTAMASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 LEU A 182
ARG A 183
THR A 199
GLY A  47
 None
 0.90A 3ny4A-3agrA:
undetectable		 3ny4A-3agrA:
18.75
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.
3P73_A_ACTA275_0
(MHC RFP-Y CLASS I
ALPHA CHAIN)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ILE A 327
VAL A 413
ARG A 338
 None
 0.72A 3p73A-3agrA:
undetectable		 3p73A-3agrA:
18.66
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.
3R24_A_SAMA302_0
(2'-O-METHYL
TRANSFERASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 12 GLY A 166
SER A  50
GLY A 256
LEU A  88
PHE A 170
 None
 1.42A 3r24A-3agrA:
undetectable		 3r24A-3agrA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SFE_C_TMGC1_1
(SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 ILE A 535
MET A 470
SER A 473
ILE A 474
 None
 1.12A 3sfeB-3agrA:
undetectable
3sfeC-3agrA:
undetectable		 3sfeB-3agrA:
17.55
3sfeC-3agrA:
13.09
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.
3ZOA_A_ACRA1587_2
(TREHALOSE
SYNTHASE/AMYLASE
TRES)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ARG A 289
PHE A 290
PRO A 291
 None
 0.45A 3zoaB-3agrA:
undetectable		 3zoaB-3agrA:
21.85
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.
3ZQT_A_TESA1000_1
(ANDROGEN RECEPTOR)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 12 LEU A 537
LEU A 541
LEU A 542
VAL A 464
MET A 463
 None
 1.35A 3zqtA-3agrA:
undetectable		 3zqtA-3agrA:
17.33
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.
4DAJ_B_0HKB2000_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ASN A 279
LEU A 248
PHE A 285
 None
 0.67A 4dajB-3agrA:
undetectable		 4dajB-3agrA:
22.68
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.
4M93_B_ACTB303_0
(S25-26 FAB (IGG1K)
HEAVY CHAIN
S25-26 FAB (IGG1K)
LIGHT CHAIN)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 5 GLY A 446
ALA A 438
PHE A 447
GLU A 448
 None
 0.90A 4m93B-3agrA:
undetectable
4m93C-3agrA:
undetectable		 4m93B-3agrA:
16.98
4m93C-3agrA:
16.34
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.
4PFJ_B_ADNB502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 6 GLU A 521
GLN A 516
THR A 476
ASN A 519
 None
 1.28A 4pfjB-3agrA:
undetectable		 4pfjB-3agrA:
20.67
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.
4QVW_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 11 ALA A 165
GLY A 256
GLY A 255
SER A 258
SER A 299
 None
 1.01A 4qvwK-3agrA:
undetectable
4qvwL-3agrA:
undetectable		 4qvwK-3agrA:
15.91
4qvwL-3agrA:
15.82
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.
4QVW_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 11 ALA A 165
GLY A 256
GLY A 255
SER A 258
SER A 299
 None
 1.01A 4qvwY-3agrA:
undetectable
4qvwZ-3agrA:
undetectable		 4qvwY-3agrA:
15.91
4qvwZ-3agrA:
15.82
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.
4UBE_A_2FAA401_1
(ADENOSINE KINASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 12 SER A  49
ASP A  46
GLY A  47
GLY A  48
ALA A 257
 None
 1.23A 4ubeA-3agrA:
undetectable		 4ubeA-3agrA:
20.88
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.
4WNW_B_RTZB602_2
(CYTOCHROME P450 2D6)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 GLU A 253
ILE A 207
ALA A 257
 None
 0.58A 4wnwB-3agrA:
undetectable		 4wnwB-3agrA:
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.
4ZBQ_A_DIFA601_1
(SERUM ALBUMIN)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 11 VAL A  91
LEU A 132
GLY A 127
LEU A 182
SER A 163
 None
 1.28A 4zbqA-3agrA:
undetectable		 4zbqA-3agrA:
22.12
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.
5DSG_A_0HKA1201_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 ASN A 279
LEU A 248
PHE A 285
 None
 0.76A 5dsgA-3agrA:
undetectable		 5dsgA-3agrA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FPD_B_PZAB1385_0
(HEAT SHOCK-RELATED
70KDA PROTEIN 2)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 7 ASN A 439
SER A 444
ALA A 443
GLY A 213
 None
 0.88A 5fpdB-3agrA:
4.7		 5fpdB-3agrA:
22.67
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.
5I71_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 12 ILE A  42
ALA A  41
GLY A 577
LEU A  79
VAL A 583
 None
 1.20A 5i71A-3agrA:
0.6		 5i71A-3agrA:
22.17
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.
5I75_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		5 / 12 ILE A  42
ALA A  41
GLY A 577
LEU A  79
VAL A 583
 None
 1.17A 5i75A-3agrA:
undetectable		 5i75A-3agrA:
22.17
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.
5IK1_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 7 GLY A 213
VAL A 278
ILE A 296
VAL A 295
 None
 0.63A 5ik1A-3agrA:
undetectable		 5ik1A-3agrA:
21.63
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.
5J4N_A_AG2A501_1
(ARGININE/AGMATINE
ANTIPORTER)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 6 SER A 309
GLY A 344
ASN A 363
ILE A 412
 None
 1.11A 5j4nA-3agrA:
undetectable		 5j4nA-3agrA:
22.71
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.
5KGP_B_GCSB405_1
(PREDICTED
ACETYLTRANSFERASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 8 GLU A 347
PRO A 350
GLY A 352
ASP A 351
 None
 1.13A 5kgpB-3agrA:
undetectable		 5kgpB-3agrA:
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.
5YW0_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		3 / 3 LYS A 364
ASN A 363
SER A 342
 None
 1.29A 5yw0A-3agrA:
undetectable		 5yw0A-3agrA:
18.91
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.
6GTQ_A_ACTA204_0
(N-ACETYLTRANSFERASE)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 5 LEU A 161
CYH A 162
THR A 164
GLY A  47
 None
 1.23A 6gtqA-3agrA:
undetectable		 6gtqA-3agrA:
14.43
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.
6HD6_B_STIB601_1
(TYROSINE-PROTEIN
KINASE ABL1)		 3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE
(Neospora
caninum) 		4 / 7 VAL A 561
GLY A 209
ARG A 226
ALA A 216
 None
 0.87A 6hd6B-3agrA:
undetectable		 6hd6B-3agrA:
11.23