SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5i1w'

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.
1DZ6_B_CAMB502_0
(CYTOCHROME P450-CAM)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 5 PHE A  34
TYR A  16
VAL A  28
VAL A  75
None
1.46A 1dz6B-5i1wA:
undetectable
1dz6B-5i1wA:
20.89
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.
1GEB_A_CAMA418_0
(CYTOCHROME P450-CAM)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 9 PHE A  34
TYR A  16
VAL A  28
VAL A  75
ILE A  78
None
1.40A 1gebA-5i1wA:
undetectable
1gebA-5i1wA:
21.24
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.
1JTV_A_TESA500_1
(17
BETA-HYDROXYSTEROID
DEHYDROGENASE TYPE 1)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 8 VAL A  59
TYR A 200
HIS A 186
SER A 134
FAD  A 601 (-4.5A)
None
None
None
1.01A 1jtvA-5i1wA:
undetectable
1jtvA-5i1wA:
22.76
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.
1RV7_B_AB1B1001_1
(PROTEASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 11 ASN A 460
ILE A 447
PRO A 438
VAL A 435
ALA A 494
None
1.20A 1rv7A-5i1wA:
undetectable
1rv7B-5i1wA:
undetectable
1rv7A-5i1wA:
11.18
1rv7B-5i1wA:
11.18
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.
1TMX_B_BEZB882_0
(HYDROXYQUINOL
1,2-DIOXYGENASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 LEU A 267
GLY A 139
PRO A 140
TYR A 108
HIS A 132
None
FAD  A 601 ( 4.9A)
None
None
FAD  A 601 (-4.2A)
1.26A 1tmxB-5i1wA:
undetectable
1tmxB-5i1wA:
21.83
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.
2AVD_B_SAMB601_0
(CATECHOL-O-METHYLTRA
NSFERASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 GLY A 444
VAL A 435
ASP A 346
ALA A 445
TYR A 470
None
1.33A 2avdB-5i1wA:
undetectable
2avdB-5i1wA:
19.80
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.
2JN3_A_JN3A131_1
(FATTY ACID-BINDING
PROTEIN, LIVER)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 ILE A 378
THR A 402
LEU A 400
LEU A 326
PHE A 247
None
1.20A 2jn3A-5i1wA:
undetectable
2jn3A-5i1wA:
12.32
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.
2OUZ_A_C3DA999_1
(ESTROGEN RECEPTOR)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 6 ALA A 211
ASP A 210
GLU A 214
ARG A 218
None
1.18A 2ouzA-5i1wA:
undetectable
2ouzA-5i1wA:
17.60
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.
2OXT_A_SAMA300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 GLY A 122
GLY A 130
GLY A 128
LEU A  81
ILE A 197
FAD  A 601 (-3.2A)
FAD  A 601 (-3.6A)
FAD  A 601 (-3.7A)
FAD  A 601 (-4.7A)
FAD  A 601 (-3.6A)
1.06A 2oxtA-5i1wA:
undetectable
2oxtA-5i1wA:
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.
2QBO_A_CAMA442_0
(CYTOCHROME P450-CAM)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 10 PHE A  34
TYR A  16
VAL A  28
VAL A  75
ILE A  78
None
1.45A 2qboA-5i1wA:
undetectable
2qboA-5i1wA:
22.74
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.
2R5P_B_MK1B902_2
(PROTEASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
6 / 12 GLY A 128
ALA A 129
ILE A 197
GLY A 191
VAL A 149
ILE A 133
FAD  A 601 (-3.7A)
None
FAD  A 601 (-3.6A)
FAD  A 601 (-3.3A)
None
None
1.37A 2r5pB-5i1wA:
undetectable
2r5pB-5i1wA:
10.78
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.
2VOU_B_ACTB1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 PRO A 120
GLY A 146
TYR A 151
None
0.71A 2vouB-5i1wA:
undetectable
2vouB-5i1wA:
23.64
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.
2VOU_C_ACTC1391_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 PRO A 120
GLY A 146
TYR A 151
None
0.70A 2vouC-5i1wA:
undetectable
2vouC-5i1wA:
23.64
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_DHID8_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 4 SER A 142
GLY A 146
GLY A 121
GLY A 137
None
None
None
FAD  A 601 (-3.6A)
0.80A 3bogB-5i1wA:
undetectable
3bogD-5i1wA:
undetectable
3bogB-5i1wA:
undetectable
3bogD-5i1wA:
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.
3EM4_A_DR7A100_1
(PROTEASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
6 / 11 GLY A 128
ALA A 129
ILE A 197
GLY A 191
VAL A 149
ILE A 133
FAD  A 601 (-3.7A)
None
FAD  A 601 (-3.6A)
FAD  A 601 (-3.3A)
None
None
1.40A 3em4A-5i1wA:
undetectable
3em4A-5i1wA:
10.61
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.
3JAY_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 ILE A 447
GLY A 190
GLY A 189
ALA A 185
ILE A 497
None
1.00A 3jayA-5i1wA:
undetectable
3jayA-5i1wA:
19.05
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.
3OWX_B_XRAB233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 11 VAL A  79
GLY A 130
GLY A 131
ASN A 448
ILE A 197
None
FAD  A 601 (-3.6A)
FAD  A 601 (-3.2A)
FAD  A 601 ( 3.5A)
FAD  A 601 (-3.6A)
1.32A 3owxA-5i1wA:
undetectable
3owxB-5i1wA:
undetectable
3owxA-5i1wA:
18.20
3owxB-5i1wA:
18.20
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.
3TKA_A_SAMA400_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 GLY A 349
ARG A 348
HIS A 351
ARG A 253
SER A 399
None
1.28A 3tkaA-5i1wA:
undetectable
3tkaA-5i1wA:
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.
4FGL_A_CLQA303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 GLY A 130
GLY A 131
ASN A 448
ILE A 197
VAL A  79
FAD  A 601 (-3.6A)
FAD  A 601 (-3.2A)
FAD  A 601 ( 3.5A)
FAD  A 601 (-3.6A)
None
1.21A 4fglA-5i1wA:
undetectable
4fglB-5i1wA:
undetectable
4fglA-5i1wA:
17.80
4fglB-5i1wA:
17.80
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.
4L1A_A_AB1A101_1
(MDR769 HIV-1
PROTEASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 11 ASN A 460
ASP A 451
PRO A 438
THR A 437
VAL A 435
None
1.14A 4l1aA-5i1wA:
undetectable
4l1aA-5i1wA:
11.18
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.
4TVT_A_ASCA302_0
(THAUMATIN-1)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 ARG A  35
GLN A  42
GLU A  45
None
0.76A 4tvtA-5i1wA:
undetectable
4tvtA-5i1wA:
18.59
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.
4YOA_A_017A100_1
(HIV-1 PROTEASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 6 ASN A 460
PRO A 438
THR A 437
VAL A 435
None
0.92A 4yoaA-5i1wA:
undetectable
4yoaA-5i1wA:
10.20
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.
5B2S_A_ACTA107_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 VAL A 170
THR A 172
ARG A  93
None
0.65A 5b2sB-5i1wA:
undetectable
5b2sB-5i1wA:
15.33
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.
5B2T_A_ACTA108_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 VAL A 170
THR A 172
ARG A  93
None
0.62A 5b2tB-5i1wA:
undetectable
5b2tB-5i1wA:
15.33
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.
5DV4_A_NMYA601_2
(CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 GLU A 301
TRP A 297
ASN A 254
None
1.00A 5dv4A-5i1wA:
undetectable
5dv4A-5i1wA:
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.
5ERG_B_SAMB401_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 ILE A 197
VAL A 196
GLY A 191
PHE A 491
HIS A  64
FAD  A 601 (-3.6A)
FAD  A 601 ( 4.1A)
FAD  A 601 (-3.3A)
None
FAD  A 601 ( 2.7A)
1.09A 5ergB-5i1wA:
undetectable
5ergB-5i1wA:
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.
5KOX_A_RFPA502_1
(PENTACHLOROPHENOL
4-MONOOXYGENASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 GLY A  66
GLY A 332
ILE A 336
GLY A  62
GLY A  63
67L  A 602 (-3.5A)
None
None
FAD  A 601 (-3.2A)
FAD  A 601 (-3.5A)
0.88A 5koxA-5i1wA:
undetectable
5koxA-5i1wA:
24.38
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.
5KXI_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 8 TYR A 112
TRP A 319
THR A 322
LEU A 141
None
1.46A 5kxiD-5i1wA:
undetectable
5kxiE-5i1wA:
undetectable
5kxiD-5i1wA:
20.23
5kxiE-5i1wA:
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.
5UC3_A_486A801_2
(GLUCOCORTICOID
RECEPTOR)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 5 LEU A 347
LEU A 400
MET A 375
GLN A 355
None
1.35A 5uc3A-5i1wA:
undetectable
5uc3A-5i1wA:
9.90
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.
5WM2_A_ACTA605_0
(SALICYLATE-AMP
LIGASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
3 / 3 THR A  40
THR A 198
ARG A 199
None
1.05A 5wm2A-5i1wA:
undetectable
5wm2A-5i1wA:
21.67
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.
6BRD_C_RFPC502_1
(RIFAMPIN
MONOOXYGENASE)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
5 / 12 VAL A  70
GLY A 126
VAL A 104
PHE A 119
GLY A 135
FAD  A 601 (-4.5A)
None
None
None
None
1.19A 6brdC-5i1wA:
undetectable
6brdC-5i1wA:
11.06
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.
6CNJ_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 8 TYR A 112
TRP A 319
THR A 322
LEU A 141
None
1.46A 6cnjD-5i1wA:
undetectable
6cnjE-5i1wA:
undetectable
6cnjD-5i1wA:
12.38
6cnjE-5i1wA:
10.00
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.
6HU9_S_PCFS603_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 8
CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 7 GLY A 192
PHE A 194
VAL A 159
SER A 134
FAD  A 601 (-3.8A)
None
None
None
0.98A 6hu9S-5i1wA:
undetectable
6hu9q-5i1wA:
undetectable
6hu9S-5i1wA:
10.55
6hu9q-5i1wA:
14.17
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.
6MN4_A_AM2A301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 8 HIS A 362
ARG A 419
GLU A 423
GLU A 416
None
1.21A 6mn4A-5i1wA:
undetectable
6mn4A-5i1wA:
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.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)
5i1w CRMK
(Actinoalloteichu
s
sp.
WH1-2216-6)
4 / 8 HIS A 362
ARG A 419
GLU A 423
GLU A 416
None
1.21A 6mn4B-5i1wA:
undetectable
6mn4B-5i1wA:
21.00