SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ec1'

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.
1DB1_A_VDXA428_1
(VITAMIN D NUCLEAR
RECEPTOR)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 326
LEU A 352
VAL A 353
CYH A 345
VAL A 362
 None
 1.33A 1db1A-3ec1A:
undetectable		 1db1A-3ec1A:
20.54
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.
1IE9_A_VDXA500_1
(VITAMIN D3 RECEPTOR)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 326
LEU A 352
VAL A 353
CYH A 345
VAL A 362
 None
 1.29A 1ie9A-3ec1A:
undetectable		 1ie9A-3ec1A:
20.54
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.
2OGY_B_C2FB4000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 ILE A 179
GLY A 169
SER A  87
GLN A 227
ILE A  78
 None
 1.25A 2ogyB-3ec1A:
undetectable		 2ogyB-3ec1A:
19.79
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.
3AF0_A_PAUA314_0
(PANTOTHENATE KINASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 8 LEU A 303
GLY A 263
TYR A 299
TYR A 314
 None
 1.03A 3af0A-3ec1A:
undetectable		 3af0A-3ec1A:
23.94
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.
3BEX_F_PAUF248_0
(TYPE III
PANTOTHENATE KINASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 11 THR A 177
ASN A 180
GLY A 221
ASP A 218
ILE A  78
 GDP  A 900 (-3.8A)
None
GDP  A 900 ( 4.9A)
None
None
 1.24A 3bexE-3ec1A:
undetectable
3bexF-3ec1A:
undetectable		 3bexE-3ec1A:
23.24
3bexF-3ec1A:
23.24
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.
3BF1_B_PAUB248_0
(TYPE III
PANTOTHENATE KINASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 THR A 177
ASN A 180
GLY A 221
ASP A 218
ILE A  78
 GDP  A 900 (-3.8A)
None
GDP  A 900 ( 4.9A)
None
None
 1.25A 3bf1A-3ec1A:
undetectable
3bf1B-3ec1A:
undetectable		 3bf1A-3ec1A:
23.24
3bf1B-3ec1A:
23.24
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.
3BF1_E_PAUE248_0
(TYPE III
PANTOTHENATE KINASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 11 ASN A 180
GLY A 221
ASP A 218
ILE A  78
THR A 177
 None
GDP  A 900 ( 4.9A)
None
None
GDP  A 900 (-3.8A)
 1.24A 3bf1E-3ec1A:
undetectable
3bf1F-3ec1A:
undetectable		 3bf1E-3ec1A:
23.24
3bf1F-3ec1A:
23.24
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.
3BRF_A_SORA1_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 GLY A  86
ASP A  83
SER A 338
 None
 0.71A 3brfA-3ec1A:
undetectable		 3brfA-3ec1A:
21.03
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.
3BU1_A_HSMA301_1
(LIPOCALIN)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 7 SER A 367
VAL A 278
TYR A 280
ILE A 369
 None
 1.25A 3bu1A-3ec1A:
undetectable		 3bu1A-3ec1A:
16.24
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.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 326
LEU A 352
VAL A 353
CYH A 345
VAL A 362
 None
 1.28A 3m7rA-3ec1A:
undetectable		 3m7rA-3ec1A:
21.29
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.
3NUV_A_ASDA126_1
(STEROID
DELTA-ISOMERASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 LEU A 253
PHE A 277
VAL A 343
ALA A 265
PHE A 337
 None
 1.46A 3nuvA-3ec1A:
undetectable		 3nuvA-3ec1A:
14.91
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.
3QXV_D_MTXD2000_2
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 LEU A 267
ARG A 365
ASN A 346
 None
 0.75A 3qxvD-3ec1A:
undetectable		 3qxvD-3ec1A:
14.95
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.
3QXV_D_MTXD2000_2
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 LEU A 352
ARG A 365
ASN A 346
 None
 0.78A 3qxvD-3ec1A:
undetectable		 3qxvD-3ec1A:
14.95
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.
3T3S_F_9PLF1_1
(CYTOCHROME P450 2A13)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 8 ALA A  96
PHE A 198
ASN A  99
THR A 219
 None
 0.94A 3t3sF-3ec1A:
undetectable		 3t3sF-3ec1A:
21.96
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.
3WAR_A_NIOA401_1
(CASEIN KINASE II
SUBUNIT ALPHA)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 8 VAL A  76
VAL A 165
ILE A 208
ILE A 182
 None
 0.66A 3warA-3ec1A:
undetectable		 3warA-3ec1A:
20.48
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.
4HDL_A_DXCA75_0
(PPCA)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 8 ILE A 156
LYS A 175
ILE A 179
GLY A 105
 None
 0.80A 4hdlA-3ec1A:
undetectable		 4hdlA-3ec1A:
12.10
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.
4XE0_A_40LA1101_0
(PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT DELTA
ISOFORM)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 ILE A 101
VAL A 165
ASP A 218
THR A 219
ILE A  68
 None
 1.34A 4xe0A-3ec1A:
undetectable		 4xe0A-3ec1A:
16.65
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.
5IEN_A_VDYA201_2
(CDL2.2)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 12 ILE A 246
PRO A 242
LEU A 120
ILE A  81
GLY A  86
 None
 1.15A 5ienA-3ec1A:
undetectable		 5ienA-3ec1A:
16.62
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.
5OM2_B_DXTB501_1
(ALPHA-1-ANTICHYMOTRY
PSIN)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		5 / 9 VAL A 362
ALA A 265
PHE A 261
VAL A 343
ILE A 335
 None
 1.03A 5om2A-3ec1A:
undetectable
5om2B-3ec1A:
undetectable		 5om2A-3ec1A:
12.47
5om2B-3ec1A:
7.52
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.
5TJY_A_BEZA304_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 MET A 149
GLU A 184
ARG A 181
 None
 0.86A 5tjyA-3ec1A:
undetectable		 5tjyA-3ec1A:
23.04
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.
5TJZ_A_BEZA302_0
(4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 MET A 149
GLU A 184
ARG A 181
 None
 0.81A 5tjzA-3ec1A:
undetectable		 5tjzA-3ec1A:
23.04
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.
5TT3_H_EZLH303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		4 / 8 HIS A 355
VAL A 353
LEU A 292
ALA A 295
 None
 0.93A 5tt3H-3ec1A:
undetectable		 5tt3H-3ec1A:
21.52
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.
5U63_B_ACTB405_0
(THIOREDOXIN
REDUCTASE)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 GLY A 262
LEU A 307
HIS A 288
 None
 0.68A 5u63B-3ec1A:
undetectable		 5u63B-3ec1A:
23.29
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.
5X1B_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 3)		 3ec1 YQEH GTPASE
(Geobacillus
stearothermophil
us) 		3 / 3 ARG A 249
PHE A 260
LEU A 285
 None
 0.91A 5x1bC-3ec1A:
undetectable		 5x1bC-3ec1A:
20.47