SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3cea'

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)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 10 PHE A 107
VAL A 110
ILE A 187
PRO A  84
GLY A 104
 None
 1.40A 13gsA-3ceaA:
undetectable		 13gsA-3ceaA:
19.94
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.
13GS_B_SASB211_1
(GLUTATHIONE
S-TRANSFERASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 9 PHE A 107
VAL A 110
ILE A 187
PRO A  84
GLY A 104
 None
 1.40A 13gsB-3ceaA:
undetectable		 13gsB-3ceaA:
19.94
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.
1DMA_A_NCAA700_0
(EXOTOXIN A)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 GLY A  14
TYR A  62
LEU A  41
ALA A  40
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.2A)
NAD  A 400 (-3.6A)
 0.91A 1dmaA-3ceaA:
undetectable		 1dmaA-3ceaA:
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.
1E7C_A_HLTA4008_1
(SERUM ALBUMIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 8 ALA A  38
LEU A  53
LEU A  35
ALA A  23
 None
 0.80A 1e7cA-3ceaA:
undetectable		 1e7cA-3ceaA:
21.51
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.
1SDV_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 10 ALA A 173
GLY A 179
GLY A 180
ILE A 181
ILE A 219
 None
 0.86A 1sdvA-3ceaA:
undetectable		 1sdvA-3ceaA:
15.63
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.
2FK8_A_SAMA302_0
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 ILE A  13
GLY A  14
GLY A  16
LEU A  41
ALA A  78
 NAD  A 400 (-4.9A)
NAD  A 400 (-3.3A)
NAD  A 400 (-3.3A)
NAD  A 400 (-4.2A)
NAD  A 400 (-4.2A)
 0.92A 2fk8A-3ceaA:
5.4		 2fk8A-3ceaA:
20.38
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.
2TSR_C_D16C509_1
(THYMIDYLATE SYNTHASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 10 ARG A  17
PHE A 169
GLU A 223
ILE A 181
GLY A 159
 NAD  A 400 (-3.2A)
None
None
None
None
 1.42A 2tsrC-3ceaA:
undetectable		 2tsrC-3ceaA:
21.95
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.
3KEE_A_30BA500_1
(GENOME POLYPROTEIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 HIS A  22
GLY A 128
ARG A  21
ALA A 296
ASP A 294
 None
 1.11A 3keeA-3ceaA:
undetectable		 3keeA-3ceaA:
18.87
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.
3KEE_C_30BC500_1
(GENOME POLYPROTEIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 HIS A  22
GLY A 128
ARG A  21
ALA A 296
ASP A 294
 None
 1.08A 3keeC-3ceaA:
undetectable		 3keeC-3ceaA:
18.87
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.
3KEE_D_30BD500_1
(GENOME POLYPROTEIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 HIS A  22
GLY A 128
ARG A  21
ALA A 296
ASP A 294
 None
 1.05A 3keeD-3ceaA:
undetectable		 3keeD-3ceaA:
18.87
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.
3KO0_D_TFPD201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 8 GLY A  16
MET A 185
PHE A 172
PHE A 169
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.4A)
None
 0.98A 3ko0D-3ceaA:
undetectable
3ko0E-3ceaA:
undetectable		 3ko0D-3ceaA:
15.03
3ko0E-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_J_TFPJ201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 8 PHE A 172
PHE A 169
GLY A  16
MET A 185
 NAD  A 400 (-4.4A)
None
NAD  A 400 (-3.3A)
None
 0.90A 3ko0B-3ceaA:
undetectable
3ko0J-3ceaA:
undetectable		 3ko0B-3ceaA:
15.03
3ko0J-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_L_TFPL201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 GLY A  16
MET A 185
PHE A 172
PHE A 169
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.4A)
None
 0.95A 3ko0L-3ceaA:
undetectable
3ko0N-3ceaA:
undetectable		 3ko0L-3ceaA:
15.03
3ko0N-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_M_TFPM201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 GLY A  16
MET A 185
PHE A 172
PHE A 169
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.4A)
None
 0.89A 3ko0M-3ceaA:
undetectable
3ko0P-3ceaA:
undetectable		 3ko0M-3ceaA:
15.03
3ko0P-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_O_TFPO201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 8 GLY A  16
MET A 185
PHE A 172
PHE A 169
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.4A)
None
 0.88A 3ko0O-3ceaA:
undetectable
3ko0Q-3ceaA:
undetectable		 3ko0O-3ceaA:
15.03
3ko0Q-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_S_TFPS201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 PHE A 172
PHE A 169
GLY A  16
MET A 185
 NAD  A 400 (-4.4A)
None
NAD  A 400 (-3.3A)
None
 0.88A 3ko0K-3ceaA:
undetectable
3ko0S-3ceaA:
undetectable		 3ko0K-3ceaA:
15.03
3ko0S-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_T_TFPT201_1
(PROTEIN S100-A4)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 PHE A 172
PHE A 169
GLY A  16
MET A 185
 NAD  A 400 (-4.4A)
None
NAD  A 400 (-3.3A)
None
 0.93A 3ko0R-3ceaA:
undetectable
3ko0T-3ceaA:
undetectable		 3ko0R-3ceaA:
15.03
3ko0T-3ceaA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3THR_C_C2FC1410_0
(GLYCINE
N-METHYLTRANSFERASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		3 / 3 ARG A 131
PRO A 102
PHE A 129
 None
NAD  A 400 (-4.7A)
None
 0.90A 3thrC-3ceaA:
undetectable		 3thrC-3ceaA:
21.23
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.
4G0U_B_ASWB1301_1
(DNA TOPOISOMERASE
2-BETA)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 ILE A 163
GLY A 241
ALA A 212
GLU A 223
 None
 0.77A 4g0uB-3ceaA:
undetectable		 4g0uB-3ceaA:
19.05
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.
4PCL_B_SAMB301_0
(O-METHYLTRANSFERASE
FAMILY PROTEIN)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 GLN A 203
LEU A 229
GLY A 206
ALA A 335
ASN A 336
 None
 1.36A 4pclB-3ceaA:
7.4		 4pclB-3ceaA:
20.51
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.
5IZJ_F_AZ1F2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAR-DAR-DAR)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 7 GLY A 257
SER A 258
GLY A 260
VAL A 262
 None
 0.36A 5izjB-3ceaA:
undetectable		 5izjB-3ceaA:
21.88
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.
5KOX_A_RFPA502_1
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		6 / 12 ARG A 131
PHE A 297
GLY A 265
VAL A 251
ILE A 264
PHE A 196
 None
 1.27A 5koxA-3ceaA:
undetectable		 5koxA-3ceaA:
21.46
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.
5MVM_A_PFLA510_1
(PROTON-GATED ION
CHANNEL)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 9 ILE A  13
ALA A  11
ILE A  12
ALA A  40
LEU A  15
 NAD  A 400 (-4.9A)
None
None
NAD  A 400 (-3.6A)
None
 1.04A 5mvmA-3ceaA:
undetectable
5mvmE-3ceaA:
undetectable		 5mvmA-3ceaA:
12.38
5mvmE-3ceaA:
12.38
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.
5YW0_A_ACTA410_0
(UNCHARACTERIZED
PROTEIN KDOO)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 4 GLY A  19
LEU A  18
VAL A  77
GLU A 100
 NAD  A 400 ( 4.9A)
NAD  A 400 (-4.4A)
NAD  A 400 ( 4.6A)
NAD  A 400 (-3.2A)
 1.26A 5yw0A-3ceaA:
undetectable		 5yw0A-3ceaA:
22.47
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.
6BRD_C_RFPC502_1
(RIFAMPIN
MONOOXYGENASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 VAL A 183
MET A 130
ARG A 131
PRO A 162
GLY A 242
 None
NAD  A 400 ( 3.3A)
None
None
None
 1.05A 6brdC-3ceaA:
undetectable		 6brdC-3ceaA:
12.57
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.
6C2M_D_SUED1202_1
(NS3 PROTEASE)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		4 / 9 HIS A 244
LEU A 239
VAL A 183
ASP A 184
 None
 0.94A 6c2mD-3ceaA:
undetectable		 6c2mD-3ceaA:
20.18
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.
6GNG_B_QPSB601_2
(-)		 3cea MYO-INOSITOL
2-DEHYDROGENASE
(Lactobacillus
plantarum) 		5 / 12 GLY A  16
GLY A  19
HIS A  83
GLU A 221
ARG A  17
 NAD  A 400 (-3.3A)
NAD  A 400 ( 4.9A)
NAD  A 400 (-3.8A)
None
NAD  A 400 (-3.2A)
 1.04A 6gngB-3ceaA:
4.1		 6gngB-3ceaA:
21.91