SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2ddt'

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.
1HSH_C_MK1C402_2
(HIV-II PROTEASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 8 GLY A 193
ILE A 192
PRO A 223
ILE A 267
ILE A 303
 None
 1.35A 1hshD-2ddtA:
undetectable		 1hshD-2ddtA:
16.85
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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 6 GLU A  53
TYR A  18
GLN A 153
ASP A 253
 MG  A 310 (-2.4A)
None
None
None
 1.39A 2cl5B-2ddtA:
2.0		 2cl5B-2ddtA:
21.66
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.
2O4N_A_TPVA300_2
(PROTEASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 8 LEU A  10
ALA A 301
ILE A 267
GLY A 193
ILE A  50
 None
 1.50A 2o4nB-2ddtA:
undetectable		 2o4nB-2ddtA:
17.21
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.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 7 TYR A 242
TRP A  28
GLN A 286
TYR A 290
 MES  A 313 (-4.0A)
MES  A 313 (-3.5A)
None
MES  A 313 (-4.6A)
 1.28A 2ph9A-2ddtA:
undetectable
2ph9B-2ddtA:
undetectable		 2ph9A-2ddtA:
20.75
2ph9B-2ddtA:
20.75
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.
2ZVJ_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 6 GLU A  53
TYR A  18
GLN A 153
ASP A 253
 MG  A 310 (-2.4A)
None
None
None
 1.38A 2zvjA-2ddtA:
undetectable		 2zvjA-2ddtA:
21.10
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.
3ABK_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 GLY A 102
GLN A 116
THR A  75
PHE A 133
GLY A 149
 None
 1.25A 3abkA-2ddtA:
undetectable
3abkB-2ddtA:
0.0
3abkT-2ddtA:
0.0		 3abkA-2ddtA:
18.60
3abkB-2ddtA:
19.03
3abkT-2ddtA:
13.07
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.
3ABL_B_CHDB1086_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 GLY A 102
GLN A 116
THR A  75
PHE A 133
GLY A 149
 None
 1.22A 3ablA-2ddtA:
0.0
3ablB-2ddtA:
0.0
3ablT-2ddtA:
0.0		 3ablA-2ddtA:
18.60
3ablB-2ddtA:
19.03
3ablT-2ddtA:
13.07
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.
3ABM_B_CHDB1086_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 GLY A 102
GLN A 116
THR A  75
PHE A 133
GLY A 149
 None
 1.34A 3abmA-2ddtA:
0.0
3abmB-2ddtA:
0.0
3abmT-2ddtA:
0.0		 3abmA-2ddtA:
18.60
3abmB-2ddtA:
19.03
3abmT-2ddtA:
13.07
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.
3AG3_O_CHDO229_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 PHE A 133
GLY A 149
GLY A 102
GLN A 116
THR A  75
 None
 1.23A 3ag3G-2ddtA:
0.0
3ag3N-2ddtA:
undetectable
3ag3O-2ddtA:
0.0		 3ag3G-2ddtA:
13.07
3ag3N-2ddtA:
18.60
3ag3O-2ddtA:
19.03
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.
3BJW_G_SVRG506_3
(PHOSPHOLIPASE A2)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		3 / 3 PRO A 264
PHE A 215
LYS A 259
 None
 0.70A 3bjwG-2ddtA:
undetectable		 3bjwG-2ddtA:
17.42
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.
3FI0_O_TRPO1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 9 VAL A  54
ILE A  43
VAL A  49
VAL A 106
GLN A  74
 None
 1.24A 3fi0O-2ddtA:
undetectable		 3fi0O-2ddtA:
17.15
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.
3WIP_D_ACHD301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 8 TYR A 242
THR A 282
TYR A 290
TRP A  28
 MES  A 313 (-4.0A)
None
MES  A 313 (-4.6A)
MES  A 313 (-3.5A)
 1.45A 3wipD-2ddtA:
undetectable
3wipE-2ddtA:
0.0		 3wipD-2ddtA:
21.97
3wipE-2ddtA:
21.97
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.
4DV1_A_SRYA1601_1
(16S RRNA
RIBOSOMAL PROTEIN
S12)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		3 / 3 LYS A  69
LYS A  68
PRO A  72
 None
 0.91A 4dv1L-2ddtA:
undetectable		 4dv1L-2ddtA:
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.
4JI8_A_SRYA1601_1
(16S RRNA
RIBOSOMAL PROTEIN
S12)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		3 / 3 LYS A 140
LYS A   8
TRP A 109
 None
 1.18A 4ji8L-2ddtA:
0.0		 4ji8L-2ddtA:
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.
4OTW_A_DB8A1101_2
(RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-3)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		3 / 3 LEU A 128
LEU A  78
ASN A  92
 None
 0.72A 4otwA-2ddtA:
undetectable		 4otwA-2ddtA:
20.17
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.
4RTM_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 GLY A 101
GLY A 102
PHE A 133
ALA A 104
ILE A 115
 None
 0.93A 4rtmA-2ddtA:
undetectable		 4rtmA-2ddtA:
21.22
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.
4X3M_B_ADNB301_1
(RNA 2'-O RIBOSE
METHYLTRANSFERASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 9 LEU A  78
GLY A  79
ILE A 115
LEU A  90
VAL A 118
 None
 0.86A 4x3mB-2ddtA:
undetectable		 4x3mB-2ddtA:
19.54
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.
4XYZ_A_ACTA103_0
(POLYUBIQUITIN-C)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 4 LEU A  51
ILE A  43
HIS A  15
VAL A  49
 None
 1.01A 4xyzA-2ddtA:
undetectable		 4xyzA-2ddtA:
12.97
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.
4Y0P_A_TE4A201_1
(BETA-LACTOGLOBULIN)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 LEU A  64
VAL A 106
ILE A  43
ILE A  37
VAL A  17
 None
 1.08A 4y0pA-2ddtA:
1.6		 4y0pA-2ddtA:
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.
5B1B_G_CHDG103_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 PHE A 133
GLY A 149
GLY A 102
GLN A 116
THR A  75
 None
 1.26A 5b1bG-2ddtA:
0.0
5b1bN-2ddtA:
undetectable
5b1bO-2ddtA:
0.0		 5b1bG-2ddtA:
13.07
5b1bN-2ddtA:
18.60
5b1bO-2ddtA:
19.03
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.
5N0O_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 193
VAL A 103
ALA A 301
VAL A  48
 None
 1.13A 5n0oA-2ddtA:
undetectable		 5n0oA-2ddtA:
21.72
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 194
VAL A 103
ALA A 301
VAL A  48
 None
 1.18A 5n0oA-2ddtA:
undetectable		 5n0oA-2ddtA:
21.72
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_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 193
VAL A 103
ALA A 301
VAL A  48
 None
 1.15A 5n0oB-2ddtA:
undetectable		 5n0oB-2ddtA:
21.72
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 193
VAL A 103
ALA A 301
VAL A  48
 None
 1.15A 5n0rA-2ddtA:
undetectable		 5n0rA-2ddtA:
21.58
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 194
VAL A 103
ALA A 301
VAL A  48
 None
 1.19A 5n0rA-2ddtA:
undetectable		 5n0rA-2ddtA:
21.58
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 193
VAL A 103
ALA A 301
VAL A  48
 None
 1.16A 5n0wA-2ddtA:
undetectable		 5n0wA-2ddtA:
19.22
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 194
VAL A 103
ALA A 301
VAL A  48
 None
 1.19A 5n0wA-2ddtA:
undetectable		 5n0wA-2ddtA:
19.22
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 193
VAL A 103
ALA A 301
VAL A  48
 None
 1.18A 5n0xB-2ddtA:
undetectable		 5n0xB-2ddtA:
19.22
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)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 255
GLY A 194
VAL A 103
ALA A 301
VAL A  48
 None
 1.24A 5n0xB-2ddtA:
undetectable		 5n0xB-2ddtA:
19.22
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.
5NEL_C_ACTC302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		4 / 6 ASP A 195
HIS A 151
LEU A 252
HIS A 296
 None
 1.03A 5nelB-2ddtA:
undetectable
5nelC-2ddtA:
undetectable		 5nelB-2ddtA:
21.45
5nelC-2ddtA:
21.45
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.
5NZ0_A_ZLDA301_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 201
TRP A 232
THR A 231
VAL A 271
ASN A 199
 None
 1.35A 5nz0A-2ddtA:
undetectable		 5nz0A-2ddtA:
21.00
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.
5NZ0_A_ZLDA301_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 12 ILE A 201
TRP A 232
TYR A 297
THR A 231
ASN A 199
 None
 1.36A 5nz0A-2ddtA:
undetectable		 5nz0A-2ddtA:
21.00
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.
5Y2T_A_8LXA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		3 / 3 SER A 294
HIS A  15
TYR A  42
 None
None
SO4  A 312 (-4.8A)
 1.00A 5y2tA-2ddtA:
undetectable		 5y2tA-2ddtA:
undetectable
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.
6NKN_B_CHDB304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 2ddt SPHINGOMYELIN
PHOSPHODIESTERASE
(Bacillus
cereus) 		5 / 11 GLY A 102
GLN A 116
THR A  75
PHE A 133
GLY A 149
 None
 1.19A 6nknA-2ddtA:
0.0
6nknB-2ddtA:
0.0
6nknT-2ddtA:
0.0		 6nknA-2ddtA:
18.60
6nknB-2ddtA:
19.03
6nknT-2ddtA:
13.07