SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ss6'

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.
1MJL_A_SAMA200_0
(METHIONINE REPRESSOR
PROTEIN METJ)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ALA A 185
GLU A 363
ARG A 366
ARG A 367
LEU A 311
 None
 0.85A 1mjlA-3ss6A:
undetectable
1mjlB-3ss6A:
undetectable		 1mjlA-3ss6A:
14.77
1mjlB-3ss6A:
14.77
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.
1UUJ_B_ACTB1077_0
(PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE IB
ALPHA SUBUNIT)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		3 / 3 ARG A 366
TYR A 193
LYS A 187
 None
 1.01A 1uujB-3ss6A:
undetectable		 1uujB-3ss6A:
16.05
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.
2DPM_A_SAMA300_0
(PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1))		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 GLY A 114
GLY A 353
GLY A  91
ALA A  94
ASN A 315
 None
CSO  A  88 ( 4.4A)
None
None
None
 1.00A 2dpmA-3ss6A:
undetectable		 2dpmA-3ss6A:
20.70
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.
2F8D_A_BEZA1001_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 6 VAL A 358
SER A 359
ARG A 355
PHE A 194
 None
 0.99A 2f8dA-3ss6A:
undetectable		 2f8dA-3ss6A:
20.45
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.
2HMA_A_SAMA375_0
(PROBABLE TRNA
(5-METHYLAMINOMETHYL
-2-THIOURIDYLATE)-ME
THYLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 GLY A 353
SER A  90
THR A 352
HIS A 347
PHE A 318
 CSO  A  88 ( 4.4A)
CSO  A  88 ( 4.7A)
None
CSO  A  88 ( 4.7A)
None
 1.35A 2hmaA-3ss6A:
undetectable		 2hmaA-3ss6A:
24.14
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.
2VDV_E_SAME1287_0
(TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 GLY A 288
GLY A 290
ILE A 286
ASN A 162
ALA A 160
 None
 1.09A 2vdvE-3ss6A:
undetectable		 2vdvE-3ss6A:
19.65
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.
2VDV_F_SAMF1287_0
(TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 GLY A 288
GLY A 290
ILE A 286
ASN A 162
ALA A 160
 None
 1.10A 2vdvF-3ss6A:
undetectable		 2vdvF-3ss6A:
19.65
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.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ALA A 374
ALA A 385
GLY A 372
ILE A 388
TRP A 304
 None
 1.12A 2x1lC-3ss6A:
undetectable		 2x1lC-3ss6A:
20.26
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.
3AIA_B_SAMB206_0
(UPF0217 PROTEIN
MJ1640)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 5 SER A 359
LEU A 386
GLY A 353
GLU A 313
 None
None
CSO  A  88 ( 4.4A)
None
 1.14A 3aiaA-3ss6A:
undetectable
3aiaB-3ss6A:
undetectable		 3aiaA-3ss6A:
19.24
3aiaB-3ss6A:
19.24
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.
3BOG_C_DHIC8_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		3 / 3 SER A 119
GLY A  19
GLY A  15
 None
 0.39A 3bogA-3ss6A:
undetectable
3bogC-3ss6A:
undetectable		 3bogA-3ss6A:
undetectable
3bogC-3ss6A:
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.
3BOG_D_DVAD47_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 4 GLY A 344
GLY A 346
GLY A 247
GLY A 342
 None
 0.65A 3bogD-3ss6A:
undetectable		 3bogD-3ss6A:
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.
3BWM_A_SAMA301_0
(CATECHOL
O-METHYLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 VAL A 325
TYR A 322
ILE A 349
SER A  90
GLN A  85
 None
None
CSO  A  88 ( 4.4A)
CSO  A  88 ( 4.7A)
None
 1.38A 3bwmA-3ss6A:
undetectable		 3bwmA-3ss6A:
20.31
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.
3BWY_A_SAMA301_0
(COMT PROTEIN)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 VAL A 325
TYR A 322
ILE A 349
SER A  90
GLN A  85
 None
None
CSO  A  88 ( 4.4A)
CSO  A  88 ( 4.7A)
None
 1.35A 3bwyA-3ss6A:
undetectable		 3bwyA-3ss6A:
21.34
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.
3EKT_B_017B200_1
(PROTEASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 9 GLY A 353
ALA A 354
VAL A 254
GLY A 251
ILE A  14
 CSO  A  88 ( 4.4A)
None
None
None
None
 1.07A 3ektA-3ss6A:
undetectable		 3ektA-3ss6A:
14.29
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.
3FPJ_B_SAMB301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 7 GLY A 340
GLY A 342
GLU A 316
ALA A 185
 None
 0.77A 3fpjB-3ss6A:
undetectable		 3fpjB-3ss6A:
20.85
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.
3HUO_B_PNNB301_0
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 CYH A 351
GLY A 114
SER A 252
GLY A 251
ASP A 250
 None
 1.02A 3huoB-3ss6A:
undetectable		 3huoB-3ss6A:
21.01
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.
3MBG_A_ACTA500_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 4 ALA A 185
HIS A 182
HIS A 217
PRO A 218
 None
 1.22A 3mbgA-3ss6A:
0.4		 3mbgA-3ss6A:
15.49
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.
3MBG_C_ACTC900_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 4 ALA A 185
HIS A 182
HIS A 217
PRO A 218
 None
 1.22A 3mbgC-3ss6A:
0.4		 3mbgC-3ss6A:
15.49
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.
3R9T_B_BEZB264_0
(ECHA1_1)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 7 ILE A  95
LEU A 257
ALA A   9
ALA A   8
 None
None
K  A 396 (-4.8A)
K  A 396 (-4.0A)
 0.86A 3r9tB-3ss6A:
undetectable		 3r9tB-3ss6A:
24.63
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.
4E47_C_SAMC800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.29A 4e47C-3ss6A:
undetectable		 4e47C-3ss6A:
21.09
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.
4E47_D_SAMD800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 10 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.24A 4e47D-3ss6A:
undetectable		 4e47D-3ss6A:
21.09
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.
4J83_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.38A 4j83A-3ss6A:
undetectable		 4j83A-3ss6A:
21.20
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.
4JDS_C_SAMC401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.32A 4jdsC-3ss6A:
undetectable		 4jdsC-3ss6A:
21.09
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.
4JDS_D_SAMD401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.29A 4jdsD-3ss6A:
undetectable		 4jdsD-3ss6A:
21.09
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.
4JLG_B_SAMB401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A   6
ALA A 272
GLU A 389
GLY A 368
HIS A 362
 None
None
None
None
K  A 396 ( 4.9A)
 1.30A 4jlgB-3ss6A:
undetectable		 4jlgB-3ss6A:
21.09
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.
4XUD_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 VAL A 325
TYR A 322
ILE A 349
SER A  90
GLN A  85
 None
None
CSO  A  88 ( 4.4A)
CSO  A  88 ( 4.7A)
None
 1.39A 4xudA-3ss6A:
undetectable		 4xudA-3ss6A:
20.62
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.
4XUE_B_SAMB303_0
(CATECHOL
O-METHYLTRANSFERASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 VAL A 325
TYR A 322
ILE A 349
SER A  90
GLN A  85
 None
None
CSO  A  88 ( 4.4A)
CSO  A  88 ( 4.7A)
None
 1.33A 4xueB-3ss6A:
undetectable		 4xueB-3ss6A:
20.67
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.
4Z4C_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 6 ARG A 355
GLN A 197
ILE A  14
ASP A 215
 None
 1.18A 4z4cA-3ss6A:
undetectable		 4z4cA-3ss6A:
19.14
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.
4Z4D_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 6 ARG A 355
GLN A 197
ILE A  14
ASP A 215
 None
 1.14A 4z4dA-3ss6A:
undetectable		 4z4dA-3ss6A:
19.14
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.
4Z4H_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 5 ARG A 355
GLN A 197
ILE A  14
ASP A 215
 None
 1.14A 4z4hA-3ss6A:
undetectable		 4z4hA-3ss6A:
19.14
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.
5HFJ_F_SAMF301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 ASP A 221
ALA A 220
ASP A 215
GLY A 344
SER A 341
 SO4  A 392 (-3.4A)
SO4  A 392 (-3.7A)
None
None
None
 1.29A 5hfjF-3ss6A:
undetectable		 5hfjF-3ss6A:
20.45
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.
5HW4_A_SAMA801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 ILE A 169
ASP A 175
ALA A 320
LEU A 163
GLU A 161
 None
 1.00A 5hw4A-3ss6A:
undetectable		 5hw4A-3ss6A:
22.36
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.
5HW4_B_SAMB801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 11 ILE A 169
ASP A 175
ALA A 320
LEU A 163
GLU A 161
 None
 1.07A 5hw4B-3ss6A:
undetectable		 5hw4B-3ss6A:
22.36
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.
5HW4_C_SAMC801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 ILE A 169
ASP A 175
ALA A 320
LEU A 163
GLU A 161
 None
 1.04A 5hw4C-3ss6A:
undetectable		 5hw4C-3ss6A:
22.36
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.
5HWA_A_GCSA303_1
(CHITOSANASE)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 5 HIS A  55
VAL A 254
GLY A  91
ALA A 354
 None
 1.06A 5hwaA-3ss6A:
undetectable		 5hwaA-3ss6A:
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.
5NU7_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 4)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		4 / 8 LEU A 257
ALA A 374
VAL A 110
TYR A 277
 None
 1.02A 5nu7A-3ss6A:
undetectable		 5nu7A-3ss6A:
18.87
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.
6FBP_B_ADNB404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3ss6 ACETYL-COA
ACETYLTRANSFERASE
(Bacillus
anthracis) 		5 / 12 ASP A 195
ILE A 198
PRO A 218
SER A 359
PHE A 194
 None
 1.45A 6fbpA-3ss6A:
undetectable
6fbpB-3ss6A:
undetectable		 6fbpA-3ss6A:
9.90
6fbpB-3ss6A:
9.90