SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5dot'

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.
13GS_A_SASA211_1
(GLUTATHIONE
S-TRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 PHE A 192
VAL A 190
ILE A 173
PRO A 195
GLY A  69
None
1.23A 13gsA-5dotA:
undetectable
13gsA-5dotA:
9.54
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.
13GS_B_SASB211_1
(GLUTATHIONE
S-TRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 PHE A 192
VAL A 190
ILE A 173
PRO A 195
GLY A  69
None
1.23A 13gsB-5dotA:
undetectable
13gsB-5dotA:
9.54
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.
1A4G_A_ZMRA466_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.30A 1a4gA-5dotA:
undetectable
1a4gA-5dotA:
13.61
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.
1CBS_A_REAA200_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
TYPE II)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A1296
ILE A1230
ALA A1180
VAL A1242
LEU A1271
None
0.88A 1cbsA-5dotA:
undetectable
1cbsA-5dotA:
6.76
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.
1DTL_A_BEPA206_1
(CARDIAC TROPONIN C)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 GLN A 318
PRO A 384
GLU A 763
GLU A 950
None
1.12A 1dtlA-5dotA:
undetectable
1dtlA-5dotA:
8.05
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.
1ETA_1_T441128_1
(TRANSTHYRETIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 LYS A 182
GLU A 184
ALA A  68
LEU A 180
None
1.18A 1eta1-5dotA:
undetectable
1eta1-5dotA:
7.76
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.
1FDU_A_ESTA351_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A 150
LEU A 153
GLY A 102
LEU A  94
VAL A 128
None
0.98A 1fduA-5dotA:
4.7
1fduA-5dotA:
13.43
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.
1HVY_B_D16B415_1
(THYMIDYLATE SYNTHASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLU A 545
ASN A 698
ASP A 442
GLY A 510
ALA A 724
None
1.31A 1hvyB-5dotA:
undetectable
1hvyB-5dotA:
11.15
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.
1MXD_A_ACRA732_1
(ALPHA AMYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 GLY A 439
GLY A 432
GLY A 510
GLY A 509
ASP A 442
None
1.04A 1mxdA-5dotA:
undetectable
1mxdA-5dotA:
14.07
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.
1MXG_A_ACRA442_1
(ALPHA AMYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 GLY A 439
GLY A 432
GLY A 510
GLY A 509
ASP A 442
None
1.02A 1mxgA-5dotA:
undetectable
1mxgA-5dotA:
14.07
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)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 MET A 313
ASN A 315
GLY A 317
LEU A 947
THR A 360
None
NI  A1601 (-3.3A)
None
None
None
1.47A 1p93B-5dotA:
undetectable
1p93B-5dotA:
11.23
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.
1RH3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ILE A1357
LEU A1464
PHE A1473
ILE A1362
LEU A1381
None
1.34A 1rh3A-5dotA:
2.5
1rh3A-5dotA:
8.25
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.
1SQN_A_NDRA1001_0
(PROGESTERONE
RECEPTOR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A 526
LEU A 520
GLN A 490
LEU A 426
MET A 462
None
1.46A 1sqnA-5dotA:
undetectable
1sqnA-5dotA:
10.49
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_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 LYS A1309
ASP A 993
CYH A 981
None
1.36A 2br4F-5dotA:
4.8
2br4F-5dotA:
10.43
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.
2BXE_B_1FLB2001_1
(SERUM ALBUMIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A 410
ILE A 406
VAL A 374
GLY A 363
LEU A 390
None
0.96A 2bxeB-5dotA:
undetectable
2bxeB-5dotA:
17.58
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.
2FR3_A_REAA300_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A1296
ILE A1230
ALA A1180
VAL A1242
LEU A1271
None
0.92A 2fr3A-5dotA:
undetectable
2fr3A-5dotA:
6.76
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.
2GL0_B_ADNB902_1
(CONSERVED
HYPOTHETICAL PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ASN A 752
ILE A 750
THR A 758
ASN A 357
VAL A 637
None
1.46A 2gl0B-5dotA:
undetectable
2gl0C-5dotA:
undetectable
2gl0B-5dotA:
8.13
2gl0C-5dotA:
8.13
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.
2HA2_A_SCKA901_1
(ACETYLCHOLINESTERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 TYR A 768
ASP A 767
TYR A 959
HIS A 967
None
1.29A 2ha2A-5dotA:
undetectable
2ha2A-5dotA:
16.92
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.
2HA2_B_SCKB951_1
(ACETYLCHOLINESTERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 TYR A 768
ASP A 767
TYR A 959
HIS A 967
None
1.32A 2ha2B-5dotA:
undetectable
2ha2B-5dotA:
16.92
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.
2HS1_B_017B203_1
(HIV-1 PROTEASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 GLU A 440
PRO A 464
MET A 462
GLY A 509
None
1.21A 2hs1B-5dotA:
undetectable
2hs1B-5dotA:
6.06
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.
2J9D_J_ACTJ1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 LYS A 740
GLU A 455
ILE A 745
ILE A 750
None
0.93A 2j9dJ-5dotA:
undetectable
2j9dK-5dotA:
undetectable
2j9dL-5dotA:
undetectable
2j9dJ-5dotA:
5.87
2j9dK-5dotA:
5.87
2j9dL-5dotA:
5.87
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.
2QBN_A_CAMA442_0
(CYTOCHROME P450-CAM)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 THR A1019
VAL A 997
VAL A1012
VAL A 978
None
0.86A 2qbnA-5dotA:
undetectable
2qbnA-5dotA:
13.69
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.
2QEB_A_HSMA145_1
(D7R4 PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 ILE A 100
PHE A 877
ASP A 874
GLU A 651
None
1.03A 2qebA-5dotA:
undetectable
2qebA-5dotA:
6.63
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.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 GLU A 288
PRO A 289
ILE A 398
GLY A 258
None
1.12A 2qeuA-5dotA:
undetectable
2qeuC-5dotA:
undetectable
2qeuA-5dotA:
6.28
2qeuC-5dotA:
6.28
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.
2W8Y_B_NDRB1000_0
(PROGESTERONE
RECEPTOR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A 526
LEU A 520
GLN A 490
LEU A 426
MET A 462
None
1.48A 2w8yB-5dotA:
undetectable
2w8yB-5dotA:
10.63
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.
2Y7H_B_SAMB530_1
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 TYR A 962
GLU A1038
THR A 928
None
EDO  A1603 (-3.3A)
None
0.97A 2y7hB-5dotA:
2.5
2y7hB-5dotA:
17.36
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.
2YA7_C_ZMRC1776_2
(NEURAMINIDASE A)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 ARG A 932
ASP A1042
ILE A1043
GLU A1034
None
None
None
EDO  A1603 (-2.7A)
1.41A 2ya7C-5dotA:
undetectable
2ya7C-5dotA:
15.88
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.
2ZT7_A_GLYA1300_0
(GLYCYL-TRNA
SYNTHETASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 ARG A 718
GLU A 696
GLU A 635
SER A 723
None
1.06A 2zt7A-5dotA:
2.8
2zt7A-5dotA:
19.53
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.
3BEX_D_PAUD248_0
(TYPE III
PANTOTHENATE KINASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 LEU A 274
ASN A 199
GLY A 226
THR A 295
ILE A 299
None
None
EDO  A1606 ( 4.1A)
None
None
1.41A 3bexC-5dotA:
undetectable
3bexD-5dotA:
undetectable
3bexC-5dotA:
10.28
3bexD-5dotA:
10.28
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.
3BEX_E_PAUE248_0
(TYPE III
PANTOTHENATE KINASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ASN A 199
GLY A 226
THR A 295
ILE A 299
LEU A 274
None
EDO  A1606 ( 4.1A)
None
None
None
1.41A 3bexE-5dotA:
undetectable
3bexF-5dotA:
undetectable
3bexE-5dotA:
10.28
3bexF-5dotA:
10.28
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.
3BF1_D_PAUD248_0
(TYPE III
PANTOTHENATE KINASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 LEU A 274
ASN A 199
GLY A 226
THR A 295
ILE A 299
None
None
EDO  A1606 ( 4.1A)
None
None
1.38A 3bf1C-5dotA:
undetectable
3bf1D-5dotA:
2.5
3bf1C-5dotA:
10.28
3bf1D-5dotA:
10.28
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.
3D41_A_FCNA4001_1
(FOMA PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 8 GLY A 510
GLY A 509
GLY A 429
ILE A 427
SER A 444
None
1.46A 3d41A-5dotA:
undetectable
3d41A-5dotA:
12.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D90_A_NOGA1001_1
(PROGESTERONE
RECEPTOR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 LEU A 526
LEU A 520
GLN A 490
LEU A 426
MET A 462
None
1.46A 3d90A-5dotA:
undetectable
3d90A-5dotA:
10.57
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.
3DH0_A_SAMA220_0
(SAM DEPENDENT
METHYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A 911
PHE A 823
PHE A 805
THR A 804
LEU A 134
None
None
None
EDO  A1604 ( 4.7A)
None
1.14A 3dh0A-5dotA:
2.2
3dh0A-5dotA:
9.47
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.
3ELZ_C_CHDC151_0
(ILEAL BILE
ACID-BINDING PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ILE A 161
ILE A 183
VAL A  67
GLY A  69
LEU A 169
None
1.28A 3elzC-5dotA:
undetectable
3elzC-5dotA:
7.73
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.
3ETE_F_H3PF552_1
(GLUTAMATE
DEHYDROGENASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 HIS A  63
LYS A 157
ILE A 126
TYR A  80
None
1.01A 3eteD-5dotA:
undetectable
3eteF-5dotA:
undetectable
3eteD-5dotA:
16.67
3eteF-5dotA:
16.67
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.
3FHX_B_PXLB313_1
(PYRIDOXAL KINASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 VAL A 997
VAL A1012
THR A1019
VAL A 469
None
1.09A 3fhxB-5dotA:
4.4
3fhxB-5dotA:
12.25
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.
3HEG_A_BAXA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 VAL A 223
ILE A 281
ILE A 261
LEU A 260
None
0.66A 3hegA-5dotA:
undetectable
3hegA-5dotA:
12.68
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.
3IA4_D_MTXD164_2
(DIHYDROFOLATE
REDUCTASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ARG A1174
ILE A1192
THR A1270
None
0.71A 3ia4D-5dotA:
undetectable
3ia4D-5dotA:
7.75
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.
3IK3_A_0LIA1_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 LEU A 514
VAL A 457
ILE A 427
ARG A 419
None
1.28A 3ik3A-5dotA:
undetectable
3ik3A-5dotA:
10.88
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.
3IK3_B_0LIB2_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 7 LEU A 514
VAL A 457
ILE A 427
ARG A 419
None
1.27A 3ik3B-5dotA:
undetectable
3ik3B-5dotA:
10.88
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.
3ILU_B_HFZB800_1
(GLUTAMATE RECEPTOR 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 PRO A 268
LEU A 274
ILE A 299
SER A 294
GLY A 296
None
1.44A 3iluB-5dotA:
undetectable
3iluE-5dotA:
undetectable
3iluB-5dotA:
11.09
3iluE-5dotA:
11.09
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.
3JQ7_B_DX2B271_1
(PTERIDINE REDUCTASE
1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 ARG A1453
SER A1314
LEU A1438
PRO A1439
None
0.94A 3jq7B-5dotA:
6.0
3jq7B-5dotA:
12.01
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)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ASN A1016
ASP A 993
ARG A 718
None
0.92A 3k13C-5dotA:
undetectable
3k13C-5dotA:
12.36
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.
3K39_C_BCZC1001_0
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.36A 3k39C-5dotA:
undetectable
3k39C-5dotA:
13.99
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.
3K39_I_BCZI1001_0
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.34A 3k39I-5dotA:
undetectable
3k39I-5dotA:
13.99
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.
3K39_J_BCZJ1001_0
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.36A 3k39J-5dotA:
undetectable
3k39J-5dotA:
13.99
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.
3K39_K_BCZK1001_0
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.35A 3k39K-5dotA:
undetectable
3k39K-5dotA:
13.99
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.
3K39_L_BCZL1001_0
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.36A 3k39L-5dotA:
undetectable
3k39L-5dotA:
13.99
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.
3KKZ_B_SAMB302_0
(UNCHARACTERIZED
PROTEIN Q5LES9)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A  91
GLY A 264
GLY A 266
ALA A  88
ASN A 336
None
0.98A 3kkzB-5dotA:
undetectable
3kkzB-5dotA:
10.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_A_CELA682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 375
LEU A 290
GLY A 305
ALA A 304
LEU A 282
None
1.02A 3ln1A-5dotA:
undetectable
3ln1A-5dotA:
17.52
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.
3LN1_A_CELA682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.95A 3ln1A-5dotA:
undetectable
3ln1A-5dotA:
17.52
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.
3LN1_B_CELB682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 375
LEU A 290
GLY A 305
ALA A 304
LEU A 282
None
1.01A 3ln1B-5dotA:
undetectable
3ln1B-5dotA:
17.52
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.
3LN1_B_CELB682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.94A 3ln1B-5dotA:
undetectable
3ln1B-5dotA:
17.52
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.
3LN1_C_CELC682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.95A 3ln1C-5dotA:
undetectable
3ln1C-5dotA:
17.52
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.
3LN1_D_CELD682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 375
LEU A 290
GLY A 305
ALA A 304
LEU A 282
None
1.02A 3ln1D-5dotA:
undetectable
3ln1D-5dotA:
17.52
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.
3LN1_D_CELD682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.95A 3ln1D-5dotA:
undetectable
3ln1D-5dotA:
17.52
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.
3MBG_B_ACTB600_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 ARG A1262
ALA A1206
GLU A1175
HIS A1195
None
1.07A 3mbgB-5dotA:
undetectable
3mbgC-5dotA:
undetectable
3mbgB-5dotA:
6.82
3mbgC-5dotA:
6.82
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.
3MBG_C_ACTC600_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 GLU A1175
HIS A1195
ARG A1262
ALA A1206
None
1.07A 3mbgB-5dotA:
undetectable
3mbgC-5dotA:
undetectable
3mbgB-5dotA:
6.82
3mbgC-5dotA:
6.82
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.
3MNO_A_DEXA784_1
(GLUCOCORTICOID
RECEPTOR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ASN A  98
GLY A  76
GLN A 318
LEU A 672
ILE A 100
None
1.31A 3mnoA-5dotA:
undetectable
3mnoA-5dotA:
11.23
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.
3MNP_A_DEXA784_1
(GLUCOCORTICOID
RECEPTOR)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ASN A  98
GLY A  76
GLN A 318
LEU A 672
ILE A 100
None
1.32A 3mnpA-5dotA:
undetectable
3mnpA-5dotA:
10.40
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.
3NDI_A_SAMA601_0
(METHYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 PHE A1445
ILE A1366
PHE A1370
PHE A1374
THR A1394
None
1.25A 3ndiA-5dotA:
undetectable
3ndiA-5dotA:
14.81
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.
3OWX_B_XRAB233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 VAL A1477
PHE A1489
GLY A1339
TYR A1494
ILE A1342
None
1.16A 3owxA-5dotA:
undetectable
3owxB-5dotA:
undetectable
3owxA-5dotA:
9.51
3owxB-5dotA:
9.51
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.
3T3C_A_017A201_2
(HIV-1 PROTEASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 VAL A 231
ILE A 293
GLY A 296
ILE A 299
ALA A 222
None
1.02A 3t3cB-5dotA:
undetectable
3t3cB-5dotA:
5.62
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.
3T7S_C_SAMC300_0
(PUTATIVE
METHYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 470
GLY A 431
GLY A 429
SER A1352
GLU A 440
None
1.36A 3t7sC-5dotA:
undetectable
3t7sC-5dotA:
11.05
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.
3T7S_C_SAMC300_0
(PUTATIVE
METHYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A 264
GLY A 266
ALA A  88
TYR A  89
ASN A 336
None
1.34A 3t7sC-5dotA:
undetectable
3t7sC-5dotA:
11.05
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.
3UM5_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ILE A 801
THR A 955
SER A 953
ILE A 944
THR A 961
None
0.98A 3um5A-5dotA:
2.2
3um5A-5dotA:
17.86
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.
3V4T_A_ACTA503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ARG A 233
GLU A 379
THR A 381
None
0.86A 3v4tA-5dotA:
undetectable
3v4tA-5dotA:
15.17
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.
4A6N_C_T1CC392_1
(TETX2 PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ASN A1016
ARG A1259
ASN A1062
GLY A 980
GLY A 987
None
1.14A 4a6nC-5dotA:
3.8
4a6nC-5dotA:
13.79
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.
4B7Q_D_ZMRD601_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.34A 4b7qD-5dotA:
undetectable
4b7qD-5dotA:
15.08
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.
4CPN_A_ZMRA700_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.33A 4cpnA-5dotA:
undetectable
4cpnA-5dotA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPN_B_ZMRB700_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.36A 4cpnB-5dotA:
undetectable
4cpnB-5dotA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_C_ZMRC1470_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.28A 4cpzC-5dotA:
undetectable
4cpzC-5dotA:
16.09
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.
4CPZ_G_ZMRG1471_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.24A 4cpzG-5dotA:
undetectable
4cpzG-5dotA:
16.09
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.
4D7B_A_TCWA1126_1
(TRANSTHYRETIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 LYS A 856
LEU A 839
ALA A 853
THR A 849
None
1.20A 4d7bB-5dotA:
undetectable
4d7bB-5dotA:
6.49
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.
4E47_C_SAMC800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.28A 4e47C-5dotA:
undetectable
4e47C-5dotA:
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.
4E47_D_SAMD800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.26A 4e47D-5dotA:
undetectable
4e47D-5dotA:
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.
4FGL_A_CLQA303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A1339
TYR A1494
ILE A1342
VAL A1477
PHE A1489
None
1.18A 4fglA-5dotA:
2.9
4fglB-5dotA:
3.8
4fglA-5dotA:
9.80
4fglB-5dotA:
9.80
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.
4FGL_C_CLQC303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 GLY A  79
GLY A  78
ASN A  98
GLU A  82
None
1.00A 4fglC-5dotA:
0.6
4fglC-5dotA:
9.80
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.
4FGL_D_CLQD303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 GLY A  79
GLY A  78
ASN A  98
GLU A  82
None
0.98A 4fglD-5dotA:
undetectable
4fglD-5dotA:
9.80
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.
4FVQ_A_ACTA904_0
(TYROSINE-PROTEIN
KINASE JAK2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 PHE A 805
VAL A 666
GLU A 651
None
0.43A 4fvqA-5dotA:
undetectable
4fvqA-5dotA:
11.07
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.
4G0V_D_MIXD101_1
(DNA TOPOISOMERASE
2-BETA)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 GLY A 317
ASN A 357
GLU A 950
GLN A 678
None
1.18A 4g0vB-5dotA:
0.9
4g0vB-5dotA:
20.17
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.
4I00_A_ZMRA509_1
(NEURAMINIDASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ARG A 929
ASP A 914
ARG A 814
GLU A1034
ARG A1039
None
None
EDO  A1603 (-3.9A)
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
1.23A 4i00A-5dotA:
undetectable
4i00A-5dotA:
13.76
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.
4J5J_B_478B401_2
(PROTEASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ALA A1279
ILE A1188
VAL A1288
PRO A1294
VAL A1181
None
1.04A 4j5jB-5dotA:
undetectable
4j5jB-5dotA:
5.42
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.
4J83_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.28A 4j83A-5dotA:
0.3
4j83A-5dotA:
11.35
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.
4JDS_C_SAMC401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.26A 4jdsC-5dotA:
undetectable
4jdsC-5dotA:
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.
4JDS_D_SAMD401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.24A 4jdsD-5dotA:
undetectable
4jdsD-5dotA:
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.
4JLT_A_8PRA505_1
(CYTOCHROME P450 2B4)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 ILE A1308
GLU A1475
ALA A1349
VAL A1477
None
0.84A 4jltA-5dotA:
undetectable
4jltA-5dotA:
15.95
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.
4KR3_A_GLYA701_0
(GLYCINE--TRNA LIGASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 ARG A 718
GLU A 696
GLU A 635
SER A 723
None
1.41A 4kr3A-5dotA:
1.0
4kr3A-5dotA:
19.64
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.
4NPT_A_017A401_1
(PROTEASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 ILE A 227
GLY A 226
ILE A 201
ILE A 259
VAL A 221
None
EDO  A1606 ( 4.1A)
None
None
None
1.04A 4nptA-5dotA:
undetectable
4nptA-5dotA:
5.14
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.
4QVQ_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 ALA A1336
ALA A 467
ILE A1342
GLY A1339
ALA A1307
None
1.06A 4qvqK-5dotA:
undetectable
4qvqL-5dotA:
undetectable
4qvqK-5dotA:
9.73
4qvqL-5dotA:
10.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVQ_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 ALA A1336
ALA A 467
ILE A1342
GLY A1339
ALA A1307
None
1.06A 4qvqY-5dotA:
undetectable
4qvqZ-5dotA:
undetectable
4qvqY-5dotA:
9.73
4qvqZ-5dotA:
10.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RTB_A_SAMA501_1
(HYDG PROTEIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 GLU A1034
ARG A1039
GLN A 916
EDO  A1603 (-2.7A)
EDO  A1603 ( 3.8A)
None
0.84A 4rtbA-5dotA:
undetectable
4rtbA-5dotA:
16.47
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.
4WRY_A_URFA302_1
(URACIL-DNA
GLYCOSYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 GLY A 980
TYR A 984
SER A 988
ASN A1014
None
1.04A 4wryA-5dotA:
undetectable
4wryA-5dotA:
10.14
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.
4WRZ_A_URFA302_1
(URACIL-DNA
GLYCOSYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 8 GLY A 980
TYR A 984
SER A 988
ASN A1014
None
0.99A 4wrzA-5dotA:
undetectable
4wrzA-5dotA:
10.14
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.
4WZM_A_ACTA503_0
(RNA DEPENDENT RNA
POLYMERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 4 ASP A 767
ASP A 945
ASP A 968
ALA A 948
None
1.10A 4wzmA-5dotA:
2.4
4wzmA-5dotA:
16.40
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.
4ZZC_A_ACTA401_0
(PROTON-GATED ION
CHANNEL)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 ILE A 561
PHE A 550
ARG A 547
ILE A 713
None
1.29A 4zzcA-5dotA:
undetectable
4zzcB-5dotA:
undetectable
4zzcA-5dotA:
12.46
4zzcB-5dotA:
12.46
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.
5AYF_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 466
ALA A1336
GLU A 991
GLY A 432
ASN A 465
None
1.22A 5ayfA-5dotA:
undetectable
5ayfA-5dotA:
10.35
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.
5CDN_N_EVPN2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 GLU A 455
GLY A 509
ASP A 442
GLY A 507
None
0.90A 5cdnR-5dotA:
undetectable
5cdnS-5dotA:
2.3
5cdnR-5dotA:
16.67
5cdnS-5dotA:
8.48
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.
5CR1_A_T44A201_1
(TRANSTHYRETIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 LEU A1347
ALA A1345
LEU A1488
VAL A1306
None
1.09A 5cr1A-5dotA:
undetectable
5cr1A-5dotA:
6.92
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.
5EQB_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLY A 401
GLY A 305
GLY A 301
LEU A 290
THR A 404
None
1.05A 5eqbA-5dotA:
undetectable
5eqbA-5dotA:
16.75
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.
5G5G_A_ACTA1231_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT
PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ARG A 906
THR A 804
ASP A 135
EDO  A1604 (-3.8A)
EDO  A1604 ( 4.7A)
EDO  A1604 (-4.3A)
0.93A 5g5gA-5dotA:
undetectable
5g5gB-5dotA:
undetectable
5g5gA-5dotA:
9.82
5g5gB-5dotA:
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.
5HBS_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 422
LEU A 743
ALA A 742
ILE A 487
MET A 462
None
1.11A 5hbsA-5dotA:
undetectable
5hbsA-5dotA:
7.83
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.
5HW4_B_SAMB801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ILE A 227
GLY A 226
CYH A 225
ALA A 262
GLU A 379
None
EDO  A1606 ( 4.1A)
None
None
None
1.31A 5hw4B-5dotA:
undetectable
5hw4B-5dotA:
11.41
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.
5HW8_G_FK5G201_2
(FK506-BINDING
PROTEIN 1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 PHE A 192
VAL A  49
ILE A  48
ILE A 172
ILE A 173
None
1.21A 5hw8G-5dotA:
undetectable
5hw8G-5dotA:
6.27
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.
5IGW_A_CTYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ILE A 293
GLY A 292
ASP A  86
HIS A 377
ILE A 201
None
1.27A 5igwA-5dotA:
1.4
5igwA-5dotA:
11.71
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.
5JW1_A_CELA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 375
LEU A 290
GLY A 305
ALA A 304
LEU A 282
None
1.00A 5jw1A-5dotA:
undetectable
5jw1A-5dotA:
17.42
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.
5JW1_A_CELA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.97A 5jw1A-5dotA:
undetectable
5jw1A-5dotA:
17.42
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.
5JW1_B_CELB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 GLN A 375
LEU A 290
GLY A 305
ALA A 304
LEU A 282
None
1.05A 5jw1B-5dotA:
undetectable
5jw1B-5dotA:
17.42
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.
5KIR_A_RCXA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.96A 5kirA-5dotA:
undetectable
5kirA-5dotA:
16.51
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.95A 5kirB-5dotA:
undetectable
5kirB-5dotA:
16.51
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.
5LG3_G_Z80G401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ILE A 281
ILE A 259
VAL A 278
THR A 300
ILE A 261
None
1.26A 5lg3G-5dotA:
undetectable
5lg3G-5dotA:
12.13
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.
5LG3_H_Z80H401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 ILE A 281
ILE A 259
VAL A 278
THR A 300
ILE A 261
None
1.26A 5lg3H-5dotA:
undetectable
5lg3H-5dotA:
12.13
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.
5N0T_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 TYR A  80
SER A 148
ALA A 106
THR A 109
None
1.31A 5n0tA-5dotA:
undetectable
5n0tA-5dotA:
14.76
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.
5NUN_A_Z80A201_1
(BETA-LACTOGLOBULIN)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 9 VAL A 645
ILE A 741
ILE A 737
ILE A 750
ALA A 330
None
1.00A 5nunA-5dotA:
undetectable
5nunA-5dotA:
4.64
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.
5ODI_D_ACTD202_0
(METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
D)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 HIS A 366
GLU A 367
TRP A 349
None
1.22A 5odiD-5dotA:
2.1
5odiD-5dotA:
6.76
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.
5X23_A_LSNA502_2
(CYTOCHROME P450 2C9)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 LEU A 433
VAL A1457
ASP A1458
None
0.59A 5x23A-5dotA:
undetectable
5x23A-5dotA:
16.21
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.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 PHE A1266
GLU A1334
VAL A1335
THR A1207
GLU A1197
None
1.48A 5xiqC-5dotA:
3.2
5xiqC-5dotA:
16.60
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ARG A1089
PHE A1169
ARG A1129
None
1.24A 5y9yA-5dotA:
undetectable
5y9yA-5dotA:
13.01
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.
6A5Z_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ILE A 858
ILE A 851
LEU A 885
ILE A 873
LEU A 843
None
1.09A 6a5zD-5dotA:
undetectable
6a5zD-5dotA:
4.24
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.
6A5Z_D_9CRD501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ILE A 858
ILE A 851
PHE A 823
ILE A 873
LEU A 843
None
0.99A 6a5zD-5dotA:
undetectable
6a5zD-5dotA:
4.24
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.
6AP6_A_TLFA300_0
(PROBABLE
STRIGOLACTONE
ESTERASE DAD2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 PHE A 291
ILE A 406
VAL A 409
VAL A 374
PHE A 372
None
1.28A 6ap6A-5dotA:
undetectable
6ap6A-5dotA:
11.11
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.
6AP6_B_TLFB300_0
(PROBABLE
STRIGOLACTONE
ESTERASE DAD2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 PHE A 291
ILE A 406
VAL A 409
VAL A 374
PHE A 372
None
1.28A 6ap6B-5dotA:
undetectable
6ap6B-5dotA:
11.11
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.
6B89_B_NOVB403_2
(LIPOPOLYSACCHARIDE
EXPORT SYSTEM
ATP-BINDING PROTEIN
LPTB)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 10 LEU A1208
HIS A1195
PRO A1311
SER A1331
VAL A1201
None
1.44A 6b89B-5dotA:
undetectable
6b89B-5dotA:
5.10
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.
6C06_D_FI8D1404_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
3 / 3 ARG A1129
LYS A1139
ARG A1453
None
0.99A 6c06D-5dotA:
undetectable
6c06D-5dotA:
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.
6DWN_A_AQ4A602_1
(CYTOCHROME P450 1A1)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 5 ILE A1192
SER A1193
ALA A1180
LEU A1296
None
0.98A 6dwnA-5dotA:
undetectable
6dwnA-5dotA:
4.92
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.
6F6J_A_ACTA404_0
(L-LYSINE
3-HYDROXYLASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 ILE A1357
LEU A1488
ARG A1481
SER A1485
None
1.07A 6f6jA-5dotA:
undetectable
6f6jA-5dotA:
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.
6GTQ_B_ACTB207_0
(DUF1778
DOMAIN-CONTAINING
PROTEIN
N-ACETYLTRANSFERASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
4 / 6 LEU A1488
THR A1344
GLY A1339
ARG A1492
None
1.36A 6gtqB-5dotA:
undetectable
6gtqD-5dotA:
undetectable
6gtqB-5dotA:
8.96
6gtqD-5dotA:
3.07
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.
6HWD_H_BO2H301_0
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ALA A 271
ALA A 306
GLY A 301
THR A 300
ALA A 303
None
1.02A 6hwdH-5dotA:
undetectable
6hwdI-5dotA:
undetectable
6hwdH-5dotA:
4.34
6hwdI-5dotA:
4.56
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.
6HWD_V_BO2V301_0
(PROTEASOME SUBUNIT
BETA TYPE-2)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 ALA A 271
ALA A 306
GLY A 301
THR A 300
ALA A 303
None
1.02A 6hwdV-5dotA:
undetectable
6hwdV-5dotA:
4.34
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.
6R2E_F_FFOF403_0
(THYMIDYLATE SYNTHASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 11 PHE A 376
ASN A 674
GLY A 317
ASN A 319
ALA A  83
None
1.36A 6r2eF-5dotA:
undetectable
6r2eF-5dotA:
12.27
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.
6R2E_H_FFOH403_0
(THYMIDYLATE SYNTHASE)
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo
sapiens)
5 / 12 ILE A1060
TYR A 984
GLY A 980
ASN A1014
ALA A1260
None
1.27A 6r2eH-5dotA:
undetectable
6r2eH-5dotA:
12.27