SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2x1i'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ESW_A_ACRA651_1
(AMYLOMALTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		6 / 12 SER A  57
GLN A  60
GLN A 256
ASN A 464
PRO A 466
TRP A 473
 None
 1.08A 1eswA-2x1iA:
60.4		 1eswA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ESW_A_ACRA651_1
(AMYLOMALTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		11 / 12 SER A  57
TYR A  59
GLN A 256
TRP A 258
HIS A 294
GLU A 340
HIS A 394
ASP A 395
ASN A 464
PRO A 466
TRP A 473
 None
 0.32A 1eswA-2x1iA:
60.4		 1eswA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ESW_A_ACRA652_1
(AMYLOMALTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 6 GLY A  55
ASP A  56
GLY A  98
SER A 470
 None
 0.72A 1eswA-2x1iA:
60.4		 1eswA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ESW_A_ACRA652_1
(AMYLOMALTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 6 TYR A  54
GLY A  55
ASP A  56
GLY A  98
TYR A 101
 None
 0.47A 1eswA-2x1iA:
60.4		 1eswA-2x1iA:
86.80
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.
1FIQ_C_SALC1335_1
(XANTHINE OXIDASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 8 LEU A  11
VAL A 454
LEU A 455
ALA A 461
 None
 0.83A 1fiqC-2x1iA:
undetectable		 1fiqC-2x1iA:
20.41
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.
1HO5_A_ADNA1604_1
(5'-NUCLEOTIDASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 11 ASN A 464
SER A 459
GLY A 458
GLY A 401
ASP A 397
 None
 1.49A 1ho5A-2x1iA:
undetectable		 1ho5A-2x1iA:
24.05
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.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 12 ALA A 111
PHE A 115
GLY A 114
LEU A  77
PRO A  76
 None
 1.27A 1mj2C-2x1iA:
undetectable
1mj2D-2x1iA:
undetectable		 1mj2C-2x1iA:
11.45
1mj2D-2x1iA:
11.45
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.
1MJO_C_SAMC200_0
(METHIONINE REPRESSOR)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 12 ALA A 111
PHE A 115
GLY A 114
LEU A  77
PRO A  76
 None
 1.30A 1mjoC-2x1iA:
0.0
1mjoD-2x1iA:
0.0		 1mjoC-2x1iA:
11.45
1mjoD-2x1iA:
11.45
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.
1MJQ_A_SAMA200_0
(METHIONINE REPRESSOR)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 11 LEU A  77
PRO A  76
ALA A 111
PHE A 115
GLY A 114
 None
 1.34A 1mjqA-2x1iA:
undetectable
1mjqB-2x1iA:
undetectable		 1mjqA-2x1iA:
11.45
1mjqB-2x1iA:
11.45
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.
1MJQ_C_SAMC199_0
(METHIONINE REPRESSOR)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 10 LEU A  77
PRO A  76
ALA A 111
PHE A 115
GLY A 114
 None
 1.35A 1mjqC-2x1iA:
undetectable
1mjqD-2x1iA:
undetectable		 1mjqC-2x1iA:
11.45
1mjqD-2x1iA:
11.45
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.
1MJQ_I_SAMI199_0
(METHIONINE REPRESSOR)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 11 LEU A  77
PRO A  76
ALA A 111
PHE A 115
GLY A 114
 None
 1.35A 1mjqI-2x1iA:
undetectable
1mjqJ-2x1iA:
undetectable		 1mjqI-2x1iA:
11.45
1mjqJ-2x1iA:
11.45
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.
1R15_C_NCAC439_0
(ADP-RIBOSYL CYCLASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 TRP A 196
PHE A 210
TRP A  44
 None
 1.34A 1r15C-2x1iA:
undetectable		 1r15C-2x1iA:
19.16
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.
1R15_F_NCAF469_0
(ADP-RIBOSYL CYCLASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 TRP A 196
PHE A 210
TRP A  44
 None
 1.35A 1r15F-2x1iA:
undetectable		 1r15F-2x1iA:
19.16
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.
1R15_G_NCAG479_0
(ADP-RIBOSYL CYCLASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 TRP A 196
PHE A 210
TRP A  44
 None
 1.36A 1r15G-2x1iA:
undetectable		 1r15G-2x1iA:
19.16
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.
1R15_H_NCAH489_0
(ADP-RIBOSYL CYCLASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 TRP A 196
PHE A 210
TRP A  44
 None
 1.35A 1r15H-2x1iA:
undetectable		 1r15H-2x1iA:
19.16
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.
2DXR_A_SORA1002_0
(LACTOTRANSFERRIN)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 THR A 188
PRO A  51
TYR A 141
 None
 0.97A 2dxrA-2x1iA:
undetectable		 2dxrA-2x1iA:
20.04
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.
2J0D_A_ERYA1498_0
(CYTOCHROME P450 3A4)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 12 ARG A  80
ILE A  72
PHE A 184
ALA A 186
GLU A 123
 None
 1.10A 2j0dA-2x1iA:
undetectable		 2j0dA-2x1iA:
22.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2OWC_A_ACRA600_1
(4-ALPHA-GLUCANOTRANS
FERASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		8 / 11 SER A  57
TYR A  59
ASP A 293
HIS A 394
ASP A 395
ASN A 464
PRO A 466
TRP A 473
 None
 0.42A 2owcA-2x1iA:
60.1		 2owcA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2OWC_A_ACRA600_1
(4-ALPHA-GLUCANOTRANS
FERASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		8 / 11 SER A  57
TYR A  59
TRP A 258
HIS A 394
ASP A 395
ASN A 464
PRO A 466
TRP A 473
 None
 0.41A 2owcA-2x1iA:
60.1		 2owcA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2OWW_A_ACRA600_1
(4-ALPHA-GLUCANOTRANS
FERASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		8 / 11 SER A  57
TYR A  59
ASP A 293
HIS A 394
ASP A 395
ASN A 464
PRO A 466
TRP A 473
 None
 0.45A 2owwA-2x1iA:
59.7		 2owwA-2x1iA:
86.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2OWW_A_ACRA600_1
(4-ALPHA-GLUCANOTRANS
FERASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		7 / 11 SER A  57
TYR A  59
TRP A 258
HIS A 394
ASP A 395
PRO A 466
TRP A 473
 None
 0.68A 2owwA-2x1iA:
59.7		 2owwA-2x1iA:
86.80
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_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 5 GLN A 329
PHE A 332
LEU A 324
PHE A 298
 None
 1.44A 3ablC-2x1iA:
undetectable
3ablJ-2x1iA:
undetectable		 3ablC-2x1iA:
20.12
3ablJ-2x1iA:
7.20
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.
3B9M_A_SALA1100_1
(SERUM ALBUMIN)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 4 LEU A 324
ARG A 281
LEU A 280
ALA A 331
 None
 1.20A 3b9mA-2x1iA:
undetectable		 3b9mA-2x1iA:
21.99
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.
3FRB_X_TOPX300_1
(DIHYDROFOLATE
REDUCTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 11 LEU A 377
LEU A 435
LEU A 414
ILE A 423
TYR A 381
 None
 1.10A 3frbX-2x1iA:
undetectable		 3frbX-2x1iA:
14.23
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.
3OZW_A_KKKA413_1
(FLAVOHEMOGLOBIN)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 8 GLN A 195
ALA A 198
LEU A 199
LEU A  16
 None
 0.77A 3ozwA-2x1iA:
undetectable		 3ozwA-2x1iA:
22.37
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 10 ALA A 283
LEU A 289
ILE A 337
ALA A 339
VAL A 388
 None
 1.43A 3r9cA-2x1iA:
undetectable		 3r9cA-2x1iA:
22.81
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.
3TYE_B_YTZB902_1
(DIHYDROPTEROATE
SYNTHASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 PHE A  62
LYS A 148
SER A 149
 None
 1.21A 3tyeB-2x1iA:
8.2		 3tyeB-2x1iA:
19.88
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.
3WDM_D_ADND301_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 10 ALA A  29
GLY A  23
LEU A  49
LEU A  25
ASP A  73
 None
 1.03A 3wdmD-2x1iA:
undetectable		 3wdmD-2x1iA:
22.27
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.
4OR0_A_NPSA603_1
(SERUM ALBUMIN)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 11 SER A  15
LEU A  10
ASP A 453
LEU A 457
LEU A  11
 None
 1.41A 4or0A-2x1iA:
undetectable		 4or0A-2x1iA:
22.70
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.
4W9N_C_CCSC1548_0
(ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 ALA A 300
TRP A 316
VAL A 317
 None
 0.23A 4w9nC-2x1iA:
undetectable		 4w9nC-2x1iA:
20.90
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.
4Z4F_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 7 LEU A 438
PRO A 378
LEU A 418
TYR A 417
 None
 0.92A 4z4fA-2x1iA:
undetectable		 4z4fA-2x1iA:
18.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		6 / 12 ARG A 291
ASP A 293
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 0.89A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		6 / 12 ASP A 293
GLU A 340
GLY A 343
PHE A 366
HIS A 394
ASP A 395
 None
 0.93A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		6 / 12 GLN A 256
TRP A 258
ASP A 293
GLU A 340
GLY A 343
PHE A 366
 None
 1.18A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		6 / 12 TRP A 258
ASP A 293
GLU A 340
GLY A 343
PHE A 366
ASP A 395
 None
 1.11A 5csyB-2x1iA:
48.8		 5csyB-2x1iA:
37.48
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.
5T7B_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		4 / 7 LEU A 438
PRO A 378
LEU A 418
TYR A 417
 None
 1.02A 5t7bA-2x1iA:
undetectable		 5t7bA-2x1iA:
18.57
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.
6FGD_A_ACTA821_0
(GEPHYRIN)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 ARG A 296
PHE A 295
GLY A 297
 None
 0.76A 6fgdA-2x1iA:
undetectable		 6fgdA-2x1iA:
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.
6GNG_B_QPSB601_2
(-)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		5 / 12 GLU A 340
GLY A 343
LEU A 342
GLY A 357
PRO A 375
 None
 1.11A 6gngB-2x1iA:
undetectable		 6gngB-2x1iA:
22.47
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_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2x1i 4-ALPHA-GLUCANOTRANS
FERASE
(Thermus
brockianus) 		3 / 3 ARG A 334
PHE A 287
PHE A 332
 None
 0.89A 6nknC-2x1iA:
undetectable
6nknJ-2x1iA:
undetectable		 6nknC-2x1iA:
20.12
6nknJ-2x1iA:
7.20