SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ejn'

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.
1E7B_B_HLTB4001_1
(SERUM ALBUMIN)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 4 ARG A 440
LYS A  58
ASP A 298
GLY A 297
 None
 1.44A 1e7bB-3ejnA:
0.1		 1e7bB-3ejnA:
21.80
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.
1G60_B_SAMB501_0
(ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 ASN A 189
TRP A 184
ILE A 176
GLY A 231
THR A 331
 None
 1.14A 1g60B-3ejnA:
undetectable		 1g60B-3ejnA:
19.88
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.
1MT1_C_AG2C7004_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 6 ALA A  46
LEU A 106
LEU A 187
LEU A 157
 None
 0.83A 1mt1D-3ejnA:
undetectable
1mt1E-3ejnA:
undetectable		 1mt1D-3ejnA:
12.92
1mt1E-3ejnA:
7.81
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.
1OT7_B_IU5B1002_1
(BILE ACID RECEPTOR)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 LEU A 339
ARG A 192
ILE A 217
PHE A 214
ILE A 342
 None
 1.48A 1ot7B-3ejnA:
undetectable		 1ot7B-3ejnA:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 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_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 GLU A  93
GLY A  92
ASN A  87
ALA A  95
ALA A 100
 None
None
FMT  A   5 ( 3.9A)
None
None
 0.99A 2br4B-3ejnA:
undetectable		 2br4B-3ejnA:
20.89
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.
2W98_B_P1ZB1358_1
(PROSTAGLANDIN
REDUCTASE 2)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 6 ASP A 229
TYR A 336
TYR A 177
LEU A 333
 None
 1.03A 2w98A-3ejnA:
undetectable
2w98B-3ejnA:
undetectable		 2w98A-3ejnA:
22.80
2w98B-3ejnA:
22.80
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.
3LS4_H_TCIH220_2
(HEAVY CHAIN OF
ANTIBODY FAB
FRAGMENT
LIGHT CHAIN OF
ANTIBODY FAB
FRAGMENT)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 5 TYR A 336
GLN A 340
ILE A 352
LEU A 343
 None
 1.22A 3ls4L-3ejnA:
undetectable		 3ls4L-3ejnA:
18.99
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.
3V4T_C_ACTC502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		3 / 3 PRO A 126
ASP A 144
GLU A 142
 None
PG4  A   3 (-3.4A)
PG4  A   3 (-3.8A)
 0.78A 3v4tC-3ejnA:
undetectable		 3v4tC-3ejnA:
22.99
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.
4GH8_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 ILE A 364
ASP A 268
LEU A 417
ILE A 412
PRO A 437
 None
 1.37A 4gh8B-3ejnA:
undetectable		 4gh8B-3ejnA:
15.67
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.
5LRB_A_ACRA1003_1
(ALPHA-1,4 GLUCAN
PHOSPHORYLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 6 GLU A 329
PHE A 368
TYR A 371
PHE A 322
 None
 1.25A 5lrbA-3ejnA:
undetectable		 5lrbA-3ejnA:
18.67
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.
5LRB_B_ACRB1003_1
(ALPHA-1,4 GLUCAN
PHOSPHORYLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 9 GLU A 329
PHE A 368
TYR A 371
TYR A 421
PHE A 322
 None
 1.39A 5lrbB-3ejnA:
0.2		 5lrbB-3ejnA:
18.67
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.
6DJZ_B_GMJB301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 TYR A 116
THR A  57
TRP A 451
THR A 198
LEU A 199
 None
None
PG4  A   1 (-3.9A)
None
None
 1.34A 6djzB-3ejnA:
undetectable		 6djzB-3ejnA:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FGD_A_ACTA824_0
(GEPHYRIN)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		4 / 4 LEU A 382
ASP A 268
PRO A 269
ARG A 270
 None
 0.98A 6fgdA-3ejnA:
undetectable		 6fgdA-3ejnA:
21.40
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.
6QGB_A_BEZA701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 11 SER A 367
LEU A 382
ALA A 375
ARG A 321
PHE A 274
 None
 1.09A 6qgbA-3ejnA:
undetectable		 6qgbA-3ejnA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6QGB_B_BEZB802_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 10 SER A 367
LEU A 382
ALA A 375
ARG A 321
PHE A 274
 None
 1.10A 6qgbB-3ejnA:
undetectable		 6qgbB-3ejnA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6QGB_D_BEZD701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 10 SER A 367
LEU A 382
ALA A 375
ARG A 321
PHE A 274
 None
 1.07A 6qgbD-3ejnA:
undetectable		 6qgbD-3ejnA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6QGB_E_BEZE701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 11 SER A 367
LEU A 382
ALA A 375
ARG A 321
PHE A 274
 None
 1.11A 6qgbE-3ejnA:
undetectable		 6qgbE-3ejnA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6QGB_F_BEZF701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 10 SER A 367
LEU A 382
ALA A 375
ARG A 321
PHE A 274
 None
 1.07A 6qgbF-3ejnA:
0.2		 6qgbF-3ejnA:
21.77