SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3fd5'

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.
1KYV_A_RBFA501_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 LEU A 325
ILE A 271
ILE A 373
LEU A 293
HIS A 291
 None
 1.21A 1kyvA-3fd5A:
undetectable
1kyvE-3fd5A:
undetectable		 1kyvA-3fd5A:
18.27
1kyvE-3fd5A:
18.27
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.
1KYV_C_RBFC503_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 ILE A 373
LEU A 293
HIS A 291
LEU A 325
ILE A 271
 None
 1.24A 1kyvB-3fd5A:
undetectable
1kyvC-3fd5A:
undetectable		 1kyvB-3fd5A:
18.27
1kyvC-3fd5A:
18.27
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.
1KYV_D_RBFD504_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 ILE A 373
LEU A 293
HIS A 291
LEU A 325
ILE A 271
 None
 1.24A 1kyvC-3fd5A:
undetectable
1kyvD-3fd5A:
undetectable		 1kyvC-3fd5A:
18.27
1kyvD-3fd5A:
18.27
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.
1KYV_E_RBFE505_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 ILE A 373
LEU A 293
HIS A 291
LEU A 325
ILE A 271
 None
 1.24A 1kyvD-3fd5A:
undetectable
1kyvE-3fd5A:
undetectable		 1kyvD-3fd5A:
18.27
1kyvE-3fd5A:
18.27
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.
1N13_D_AG2D7015_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 7 LEU A 203
LEU A 325
LEU A 272
GLY A 315
 None
 0.86A 1n13D-3fd5A:
undetectable
1n13E-3fd5A:
undetectable		 1n13D-3fd5A:
15.63
1n13E-3fd5A:
8.67
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.
2AOF_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 5 LEU A 324
ASP A 265
PRO A 188
ALA A 263
 None
MG  A 395 (-2.6A)
None
None
 0.93A 2aofB-3fd5A:
undetectable		 2aofB-3fd5A:
13.21
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.
2F78_B_BEZB1004_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 7 SER A 109
LEU A 325
HIS A 274
THR A 267
 None
None
AP2  A 393 ( 4.3A)
PO4  A 394 ( 3.3A)
 1.13A 2f78B-3fd5A:
undetectable		 2f78B-3fd5A:
20.56
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.
2ZJ0_B_2FAB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 5 LEU A 324
THR A 200
THR A 117
HIS A 256
 None
 1.28A 2zj0B-3fd5A:
undetectable		 2zj0B-3fd5A:
22.48
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.
3B9L_A_AZZA1010_1
(SERUM ALBUMIN)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 8 LEU A  20
ILE A 144
PHE A 148
GLY A 173
 None
 0.94A 3b9lA-3fd5A:
undetectable		 3b9lA-3fd5A:
20.07
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.
3E4E_A_4PZA501_1
(CYTOCHROME P450 2E1)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		3 / 3 ALA A 155
THR A 157
CYH A 104
 None
 0.67A 3e4eA-3fd5A:
undetectable		 3e4eA-3fd5A:
21.13
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.
3E4E_B_4PZB501_1
(CYTOCHROME P450 2E1)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		3 / 3 ALA A 155
THR A 157
CYH A 104
 None
 0.64A 3e4eB-3fd5A:
undetectable		 3e4eB-3fd5A:
21.13
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.
3H52_C_486C4_2
(GLUCOCORTICOID
RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		3 / 3 MET A 187
CYH A 180
PRO A  74
 None
 1.29A 3h52C-3fd5A:
undetectable		 3h52C-3fd5A:
20.40
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.
3UUD_B_ESTB600_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.34A 3uudB-3fd5A:
undetectable		 3uudB-3fd5A:
21.61
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.
4LTW_A_486A302_1
(ANCESTRAL STEROID
RECEPTOR 2)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 LEU A 203
LEU A 328
ILE A 354
ILE A 271
ALA A 275
 None
 0.92A 4ltwA-3fd5A:
undetectable		 4ltwA-3fd5A:
21.55
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.
4MM5_A_SREA603_1
(TRANSPORTER)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 9 VAL A 302
ALA A 305
GLY A  28
PHE A 310
GLY A 307
 None
 1.19A 4mm5A-3fd5A:
undetectable		 4mm5A-3fd5A:
20.94
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.
4MMB_A_SREA603_1
(TRANSPORTER)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 9 VAL A 302
ALA A 305
GLY A  28
PHE A 310
GLY A 307
 None
 1.22A 4mmbA-3fd5A:
undetectable		 4mmbA-3fd5A:
20.65
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.
4MMD_A_29EA603_1
(TRANSPORTER)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 VAL A 302
ALA A 305
GLY A  28
PHE A 310
GLY A 307
 None
 1.33A 4mmdA-3fd5A:
undetectable		 4mmdA-3fd5A:
20.65
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.
4MME_A_29QA603_1
(TRANSPORTER)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 9 VAL A 302
ALA A 305
GLY A  28
PHE A 310
GLY A 307
 None
 1.21A 4mmeA-3fd5A:
undetectable		 4mmeA-3fd5A:
20.65
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.
4XI3_D_29SD601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 12 THR A 157
ALA A 155
GLU A 154
LEU A 247
ARG A 101
 None
 1.22A 4xi3D-3fd5A:
undetectable		 4xi3D-3fd5A:
21.17
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.
4ZBQ_A_DIFA602_1
(SERUM ALBUMIN)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 8 LEU A 278
ASP A 189
ASN A 190
ALA A 262
 None
 0.92A 4zbqA-3fd5A:
undetectable		 4zbqA-3fd5A:
20.56
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.
5DX3_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.30A 5dx3A-3fd5A:
undetectable		 5dx3A-3fd5A:
21.39
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.
5DX3_B_ESTB1000_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 9 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.35A 5dx3B-3fd5A:
0.0		 5dx3B-3fd5A:
21.39
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.
5DXB_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.33A 5dxbA-3fd5A:
undetectable		 5dxbA-3fd5A:
21.39
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.
5DXE_B_ESTB1000_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.35A 5dxeB-3fd5A:
undetectable		 5dxeB-3fd5A:
21.39
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.
5HYR_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.34A 5hyrA-3fd5A:
undetectable		 5hyrA-3fd5A:
21.79
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.
5HYR_B_ESTB601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 11 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.36A 5hyrB-3fd5A:
undetectable		 5hyrB-3fd5A:
21.79
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.
5I9Y_A_1N1A1001_2
(EPHRIN TYPE-A
RECEPTOR 2)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		3 / 3 ILE A 170
ILE A  92
MET A 141
 None
 0.65A 5i9yA-3fd5A:
undetectable		 5i9yA-3fd5A:
21.57
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.
5ODI_G_ACTG702_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		3 / 3 GLY A 322
THR A 200
ASN A 248
 None
 0.69A 5odiG-3fd5A:
undetectable		 5odiG-3fd5A:
20.06
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.
5WGQ_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 9 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.33A 5wgqA-3fd5A:
undetectable		 5wgqA-3fd5A:
13.88
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.
5WGQ_B_ESTB601_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.31A 5wgqB-3fd5A:
undetectable		 5wgqB-3fd5A:
13.88
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.
6CBZ_B_ESTB602_1
(ESTROGEN RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		5 / 10 ALA A 155
GLU A 154
LEU A 247
ARG A 101
LEU A 111
 None
 1.33A 6cbzB-3fd5A:
undetectable		 6cbzB-3fd5A:
13.28
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.
6CDU_G_EY4G501_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 3fd5 SELENIDE, WATER
DIKINASE 1
(Homo
sapiens) 		4 / 7 ILE A 144
VAL A 128
PRO A  91
THR A 133
 None
 1.00A 6cduF-3fd5A:
undetectable
6cduG-3fd5A:
undetectable		 6cduF-3fd5A:
20.90
6cduG-3fd5A:
20.90