SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1bg4'

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.
1FDU_B_ESTB354_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 8 SER A 143
VAL A 144
LEU A 105
TYR A 153
 NA  A 622 (-2.6A)
None
None
NA  A 622 (-4.6A)
 1.03A 1fduB-1bg4A:
1.9		 1fduB-1bg4A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FPQ_A_SAMA1699_0
(ISOLIQUIRITIGENIN
2'-O-METHYLTRANSFERA
SE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 10 GLY A 204
ASN A 173
LEU A 196
VAL A 192
ALA A 235
 None
None
None
None
NA  A 621 ( 3.8A)
 1.42A 1fpqA-1bg4A:
undetectable		 1fpqA-1bg4A:
23.40
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.
1HXB_A_ROCA100_1
(HIV-1 PROTEASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 GLY A  19
ASP A   7
GLY A  78
ILE A  81
ILE A  37
 None
GOL  A 630 (-3.5A)
None
None
None
 0.88A 1hxbA-1bg4A:
undetectable		 1hxbA-1bg4A:
15.79
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.
2KCE_A_D16A566_2
(THYMIDYLATE SYNTHASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		3 / 3 HIS A 191
ILE A 172
LEU A 177
 None
 0.72A 2kceA-1bg4A:
0.0		 2kceA-1bg4A:
20.78
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.
2QHF_A_ACTA502_0
(CHORISMATE SYNTHASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		3 / 3 GLY A 138
ASP A 137
SER A 183
 None
 0.68A 2qhfA-1bg4A:
0.0		 2qhfA-1bg4A:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ADX_A_IMNA2_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 7 ILE A 133
ILE A 234
LEU A 140
MET A 188
LEU A 196
 NA  A 622 ( 4.4A)
None
None
None
None
 1.40A 3adxA-1bg4A:
0.0		 3adxA-1bg4A:
25.52
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.
3F8W_A_ADNA300_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 SER A 228
ALA A 225
GLY A 181
ASN A 186
VAL A 189
 GOL  A 626 (-3.4A)
None
None
None
None
 1.14A 3f8wA-1bg4A:
undetectable		 3f8wA-1bg4A:
22.29
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.
3F8W_C_ADNC302_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 SER A 228
ALA A 225
GLY A 181
ASN A 186
VAL A 189
 GOL  A 626 (-3.4A)
None
None
None
None
 1.14A 3f8wC-1bg4A:
undetectable		 3f8wC-1bg4A:
22.29
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.
3HLW_B_CE3B304_1
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 5 ASN A  58
THR A 115
SER A  67
ARG A 119
 None
None
NA  A 623 (-3.3A)
GOL  A 625 (-4.9A)
 1.41A 3hlwB-1bg4A:
0.0		 3hlwB-1bg4A:
23.05
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.
3ZQ8_D_DVAD8_0
(VAL-GRAMICIDIN A)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		3 / 3 TRP A 276
VAL A 267
TRP A 268
 GOL  A 629 (-4.4A)
None
GOL  A 629 ( 3.5A)
 0.97A 3zq8C-1bg4A:
undetectable
3zq8D-1bg4A:
undetectable		 3zq8C-1bg4A:
3.68
3zq8D-1bg4A:
3.68
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.
4A97_A_ZPCA1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 7 GLU A  56
PHE A  62
HIS A  84
VAL A  71
 None
None
GOL  A 629 ( 3.8A)
None
 1.08A 4a97A-1bg4A:
undetectable		 4a97A-1bg4A:
21.30
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.
4A97_D_ZPCD1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 7 GLU A  56
PHE A  62
HIS A  84
VAL A  71
 None
None
GOL  A 629 ( 3.8A)
None
 1.04A 4a97D-1bg4A:
undetectable		 4a97D-1bg4A:
21.30
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.
4A97_I_ZPCI1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 6 GLU A  56
PHE A  62
HIS A  84
VAL A  71
 None
None
GOL  A 629 ( 3.8A)
None
 1.04A 4a97I-1bg4A:
undetectable		 4a97I-1bg4A:
21.30
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.
4IKJ_B_SUZB201_1
(TRANSTHYRETIN)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 8 SER A 280
SER A 278
LEU A 284
ALA A 244
LEU A 283
 None
 1.15A 4ikjA-1bg4A:
undetectable
4ikjB-1bg4A:
undetectable		 4ikjA-1bg4A:
17.06
4ikjB-1bg4A:
17.06
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.
4IKK_A_SUZA201_1
(TRANSTHYRETIN)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 8 LEU A 284
ALA A 244
LEU A 283
SER A 280
SER A 278
 None
 1.19A 4ikkA-1bg4A:
undetectable
4ikkB-1bg4A:
undetectable		 4ikkA-1bg4A:
17.06
4ikkB-1bg4A:
17.06
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.
5HIE_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		4 / 7 ILE A 205
GLY A 204
LEU A 109
PHE A 145
 None
 0.85A 5hieB-1bg4A:
undetectable		 5hieB-1bg4A:
22.43
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.
5N0O_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 ILE A 205
GLY A 206
PHE A 134
ALA A 229
VAL A 185
 None
None
None
NA  A 619 ( 3.8A)
None
 1.18A 5n0oA-1bg4A:
undetectable		 5n0oA-1bg4A:
21.76
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.
5N0R_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 ILE A 205
GLY A 206
PHE A 134
ALA A 229
VAL A 185
 None
None
None
NA  A 619 ( 3.8A)
None
 1.18A 5n0rA-1bg4A:
undetectable		 5n0rA-1bg4A:
21.38
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.
5N0W_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 ILE A 205
GLY A 206
PHE A 134
ALA A 229
VAL A 185
 None
None
None
NA  A 619 ( 3.8A)
None
 1.19A 5n0wA-1bg4A:
undetectable		 5n0wA-1bg4A:
21.38
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.
5N0X_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		5 / 12 ILE A 205
GLY A 206
PHE A 134
ALA A 229
VAL A 185
 None
None
None
NA  A 619 ( 3.8A)
None
 1.18A 5n0xB-1bg4A:
undetectable		 5n0xB-1bg4A:
21.38
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.
5UUN_B_ACTB309_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		3 / 3 TYR A  17
ALA A 126
TYR A 125
 NA  A 621 (-4.6A)
None
None
 0.69A 5uunB-1bg4A:
0.0		 5uunB-1bg4A:
20.69
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.
6AG0_C_ACRC608_1
(ALPHA-AMYLASE)		 1bg4 ENDO-1,4-BETA-XYLANA
SE
(Penicillium
simplicissimum) 		3 / 3 TYR A 295
ALA A 301
LEU A 302
 None
 0.56A 6ag0C-1bg4A:
10.1		 6ag0C-1bg4A:
15.05