SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wqy'

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.
1DTL_A_BEPA206_1
(CARDIAC TROPONIN C)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLN A 854
GLU A 905
ASP A 806
MET A 808
 None
 1.18A 1dtlA-3wqyA:
undetectable		 1dtlA-3wqyA:
11.07
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.
1HK2_A_T44A3003_1
(SERUM ALBUMIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 ILE A 897
LYS A 809
ALA A 834
MET A 799
 None
 1.19A 1hk2A-3wqyA:
undetectable		 1hk2A-3wqyA:
22.73
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.
1KI7_B_ID2B2_0
(THYMIDINE KINASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 GLU A 285
ILE A 330
ARG A 289
ALA A 292
GLU A 326
 None
 1.33A 1ki7B-3wqyA:
undetectable		 1ki7B-3wqyA:
16.10
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.
1MJQ_B_SAMB200_0
(METHIONINE REPRESSOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 11 GLY A 615
ARG A 418
LEU A 414
GLU A 415
PRO A 357
 None
 1.37A 1mjqA-3wqyA:
undetectable
1mjqB-3wqyA:
undetectable		 1mjqA-3wqyA:
8.01
1mjqB-3wqyA:
8.01
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.
1MJQ_H_SAMH200_0
(METHIONINE REPRESSOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 GLY A 615
ARG A 418
LEU A 414
GLU A 415
PRO A 357
 None
 1.37A 1mjqG-3wqyA:
undetectable
1mjqH-3wqyA:
undetectable		 1mjqG-3wqyA:
8.01
1mjqH-3wqyA:
8.01
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.
1NX9_A_AICA5001_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.31A 1nx9A-3wqyA:
undetectable		 1nx9A-3wqyA:
21.85
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.
1NX9_B_AICB5002_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.32A 1nx9B-3wqyA:
undetectable		 1nx9B-3wqyA:
21.85
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.
1NX9_C_AICC5003_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.31A 1nx9C-3wqyA:
undetectable		 1nx9C-3wqyA:
21.85
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.
1NX9_D_AICD5004_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.31A 1nx9D-3wqyA:
undetectable		 1nx9D-3wqyA:
21.85
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.
1P6K_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 5 GLY A 705
TRP A 664
VAL A 694
SER A 601
 None
 1.48A 1p6kB-3wqyA:
undetectable		 1p6kB-3wqyA:
16.78
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.
1Q13_A_TESA501_1
(PROSTAGLANDIN-E2
9-REDUCTASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 TYR A  84
HIS A 151
GLU A 673
VAL A 108
 None
 1.29A 1q13A-3wqyA:
undetectable		 1q13A-3wqyA:
17.72
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.
1RS6_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 5 GLY A 705
TRP A 664
VAL A 694
SER A 601
 None
 1.49A 1rs6B-3wqyA:
1.7		 1rs6B-3wqyA:
16.78
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.
1SN5_C_T3C601_1
(TRANSTHYRETIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 LEU A 213
ALA A 203
LEU A 201
VAL A 205
 None
 1.19A 1sn5A-3wqyA:
undetectable		 1sn5A-3wqyA:
8.73
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.
1SN5_C_T3C601_1
(TRANSTHYRETIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 LYS A 718
LEU A 720
GLU A 649
ALA A 740
 None
 1.18A 1sn5A-3wqyA:
undetectable		 1sn5A-3wqyA:
8.73
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.
1YA3_A_STRA1001_2
(MINERALOCORTICOID
RECEPTOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 4 LEU A 309
LEU A 297
SER A 294
LEU A 327
 None
 1.07A 1ya3A-3wqyA:
0.4		 1ya3A-3wqyA:
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.
2AW1_A_COXA264_1
(CARBONIC ANHYDRASE
II)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 ILE A 730
VAL A 634
LEU A 610
LEU A 606
THR A 603
 None
 1.02A 2aw1A-3wqyA:
undetectable		 2aw1A-3wqyA:
13.47
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.
2HMA_A_SAMA375_0
(PROBABLE TRNA
(5-METHYLAMINOMETHYL
-2-THIOURIDYLATE)-ME
THYLTRANSFERASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 11 GLY A 299
THR A 138
GLY A 139
HIS A 141
PHE A 145
 None
None
None
A5A  A1001 (-4.2A)
A5A  A1001 (-3.5A)
 1.42A 2hmaA-3wqyA:
undetectable		 2hmaA-3wqyA:
18.52
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.
2PGZ_D_COCD401_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 TRP A 252
TYR A 338
TYR A  48
ILE A  51
 None
 1.11A 2pgzD-3wqyA:
undetectable
2pgzE-3wqyA:
undetectable		 2pgzD-3wqyA:
12.50
2pgzE-3wqyA:
12.50
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)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 TRP A 252
TYR A 338
TYR A  48
ILE A  51
 None
 0.91A 2ph9A-3wqyA:
undetectable
2ph9B-3wqyA:
undetectable		 2ph9A-3wqyA:
12.50
2ph9B-3wqyA:
12.50
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.
2Q6O_A_SAMA500_0
(HYPOTHETICAL PROTEIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 ASP A 270
VAL A 269
ALA A 341
THR A 257
 None
 1.04A 2q6oA-3wqyA:
3.2		 2q6oA-3wqyA:
15.19
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.
2ROX_B_T44B128_1
(TRANSTHYRETIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 LYS A 809
GLU A 804
ALA A 834
LEU A 798
 None
 1.11A 2roxB-3wqyA:
undetectable		 2roxB-3wqyA:
9.42
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.
2WEK_B_DIFB1374_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 MET A 148
PRO A 125
ILE A 122
LEU A  70
 None
 1.15A 2wekB-3wqyA:
undetectable		 2wekB-3wqyA:
18.09
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.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLN A 105
ARG A 128
GLY A 194
GLY A 244
 None
A5A  A1001 (-3.4A)
None
A5A  A1001 (-3.7A)
 0.62A 2y6rB-3wqyA:
undetectable		 2y6rB-3wqyA:
18.06
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.
3AI8_B_HNQB255_1
(CATHEPSIN B)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 GLN A 701
GLY A 683
HIS A 604
HIS A 600
 None
 1.45A 3ai8B-3wqyA:
undetectable		 3ai8B-3wqyA:
14.63
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.
3FI0_B_TRPB1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLY A 206
ASP A 183
ILE A 184
VAL A 210
 None
 0.79A 3fi0B-3wqyA:
undetectable		 3fi0B-3wqyA:
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.
3FI0_G_TRPG1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLY A 206
ASP A 183
ILE A 184
VAL A 210
 None
 0.78A 3fi0G-3wqyA:
undetectable		 3fi0G-3wqyA:
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.
3FI0_Q_TRPQ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLY A 206
ASP A 183
ILE A 184
VAL A 210
 None
 0.76A 3fi0Q-3wqyA:
undetectable		 3fi0Q-3wqyA:
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.
3JB1_A_SAMA1101_0
(STRUCTURAL PROTEIN
VP3)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 ILE A 240
ALA A 117
ALA A 113
PRO A 106
TYR A  84
 None
 1.04A 3jb1A-3wqyA:
2.5		 3jb1A-3wqyA:
21.84
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.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLN A 105
ARG A 128
GLY A 194
GLY A 244
 None
A5A  A1001 (-3.4A)
None
A5A  A1001 (-3.7A)
 0.53A 3v3nB-3wqyA:
undetectable		 3v3nB-3wqyA:
16.57
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.
3V3N_C_MIYC2001_1
(TETX2 PROTEIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 GLN A 105
ARG A 128
GLY A 194
GLY A 244
 None
A5A  A1001 (-3.4A)
None
A5A  A1001 (-3.7A)
 0.52A 3v3nC-3wqyA:
undetectable		 3v3nC-3wqyA:
16.57
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.
4B9Z_A_ACRA1818_1
(ALPHA-GLUCOSIDASE,
PUTATIVE, ADG31B)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 TYR A 509
ASP A 544
ASP A 546
ARG A 593
HIS A 600
 None
 1.22A 4b9zA-3wqyA:
2.2		 4b9zA-3wqyA:
21.60
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.
4EJG_C_NCTC501_1
(CYTOCHROME P450 2A13)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 PHE A  72
PHE A  73
ALA A 168
LEU A 213
 None
 0.76A 4ejgC-3wqyA:
undetectable		 4ejgC-3wqyA:
18.73
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.
4EM2_A_SALA504_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR SAR2349)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 PHE A 536
GLY A 586
LEU A 550
ILE A 551
 None
 0.82A 4em2A-3wqyA:
undetectable		 4em2A-3wqyA:
10.51
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.
4K87_A_ADNA602_1
(PROLINE--TRNA LIGASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 8 ARG A 128
PHE A 145
THR A 212
ARG A 249
 A5A  A1001 (-3.4A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.7A)
 0.73A 4k87A-3wqyA:
8.8		 4k87A-3wqyA:
21.12
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.
4QZT_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 2)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		3 / 3 PHE A 401
THR A 143
LEU A 397
 None
 0.75A 4qztA-3wqyA:
undetectable		 4qztA-3wqyA:
9.82
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.
4UCK_B_SAMB2409_0
(RNA-DIRECTED RNA
POLYMERASE L)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 THR A 582
GLY A 555
GLY A 554
ASN A 553
ALA A 576
 None
 1.06A 4uckB-3wqyA:
undetectable		 4uckB-3wqyA:
17.64
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.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 ALA A 192
ARG A 234
GLY A 224
GLU A 223
 None
 0.88A 5bs8A-3wqyA:
2.8
5bs8C-3wqyA:
2.8
5bs8D-3wqyA:
undetectable		 5bs8A-3wqyA:
21.70
5bs8C-3wqyA:
21.70
5bs8D-3wqyA:
15.51
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.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 6 ALA A 192
ARG A 234
GLY A 224
GLU A 223
 None
 0.85A 5btgA-3wqyA:
2.8
5btgB-3wqyA:
undetectable
5btgC-3wqyA:
2.7		 5btgA-3wqyA:
21.70
5btgB-3wqyA:
15.51
5btgC-3wqyA:
21.70
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.
5BTG_F_LFXF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 ALA A 192
ARG A 234
GLY A 224
GLU A 223
 None
 0.77A 5btgA-3wqyA:
3.1
5btgC-3wqyA:
2.8
5btgD-3wqyA:
undetectable		 5btgA-3wqyA:
21.70
5btgC-3wqyA:
21.70
5btgD-3wqyA:
15.51
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.
5DX3_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 GLU A 813
LEU A 798
MET A 799
ARG A 801
GLY A 833
 None
 1.33A 5dx3A-3wqyA:
0.5		 5dx3A-3wqyA:
13.88
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.
5DXB_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 GLU A 813
LEU A 798
MET A 799
ARG A 801
GLY A 833
 None
 1.27A 5dxbA-3wqyA:
0.5		 5dxbA-3wqyA:
13.88
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.
5E4D_B_BEZB202_0
(HYDROXYNITRILE LYASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 VAL A 848
THR A 850
LEU A 888
VAL A 896
 None
 0.99A 5e4dA-3wqyA:
undetectable
5e4dB-3wqyA:
undetectable		 5e4dA-3wqyA:
11.73
5e4dB-3wqyA:
11.73
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.
5KKZ_E_ASCE1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 HIS A 452
ILE A 454
TYR A 419
ARG A 371
 U  C1605 ( 4.4A)
None
None
U  C1670 ( 4.0A)
 1.13A 5kkzC-3wqyA:
undetectable
5kkzE-3wqyA:
undetectable		 5kkzC-3wqyA:
12.67
5kkzE-3wqyA:
18.17
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.
5KKZ_K_ASCK1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 HIS A 452
ILE A 454
TYR A 419
ARG A 371
 U  C1605 ( 4.4A)
None
None
U  C1670 ( 4.0A)
 1.13A 5kkzK-3wqyA:
undetectable
5kkzQ-3wqyA:
0.6		 5kkzK-3wqyA:
18.17
5kkzQ-3wqyA:
12.67
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.
5KKZ_O_ASCO1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 7 HIS A 452
ILE A 454
TYR A 419
ARG A 371
 U  C1605 ( 4.4A)
None
None
U  C1670 ( 4.0A)
 1.17A 5kkzM-3wqyA:
undetectable
5kkzO-3wqyA:
undetectable		 5kkzM-3wqyA:
12.67
5kkzO-3wqyA:
18.17
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.
5KR2_C_ROCC101_2
(PROTEASE PR5-SQV)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 9 LEU A 657
ASN A 653
GLY A 737
ILE A 741
ILE A 656
 None
 1.16A 5kr2D-3wqyA:
undetectable		 5kr2D-3wqyA:
7.13
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.
5OHH_A_ACTA307_0
(CARBONIC ANHYDRASE
13)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 5 HIS A 636
HIS A 617
VAL A 356
THR A 407
 None
 1.35A 5ohhA-3wqyA:
undetectable		 5ohhA-3wqyA:
14.49
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.
6A7P_A_9SCA601_1
(SERUM ALBUMIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 5 ASN A 359
VAL A 618
LEU A 614
SER A 724
 U  C1670 ( 3.9A)
None
None
A  C1668 ( 4.7A)
 1.24A 6a7pA-3wqyA:
2.7		 6a7pA-3wqyA:
22.73
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.
6B58_A_ACTA609_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		3 / 3 HIS A 600
HIS A 707
ARG A 692
 None
 0.98A 6b58A-3wqyA:
3.0		 6b58A-3wqyA:
21.90
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.
6BNI_A_ADNA602_1
(LYSINE--TRNA LIGASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 ARG A 128
HIS A 141
PHE A 145
GLY A 246
ARG A 249
 A5A  A1001 (-3.4A)
A5A  A1001 (-4.2A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.0A)
A5A  A1001 (-3.7A)
 0.77A 6bniA-3wqyA:
11.7		 6bniA-3wqyA:
6.21
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.
6BNI_A_ADNA602_1
(LYSINE--TRNA LIGASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 HIS A 141
PHE A 145
GLU A 209
GLY A 246
ARG A 249
 A5A  A1001 (-4.2A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.8A)
A5A  A1001 (-3.0A)
A5A  A1001 (-3.7A)
 0.68A 6bniA-3wqyA:
11.7		 6bniA-3wqyA:
6.21
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 ARG A 128
HIS A 141
PHE A 145
GLY A 246
ARG A 249
 A5A  A1001 (-3.4A)
A5A  A1001 (-4.2A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.0A)
A5A  A1001 (-3.7A)
 0.73A 6bniB-3wqyA:
11.3		 6bniB-3wqyA:
6.21
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 10 HIS A 141
PHE A 145
GLU A 209
GLY A 246
ARG A 249
 A5A  A1001 (-4.2A)
A5A  A1001 (-3.5A)
A5A  A1001 (-3.8A)
A5A  A1001 (-3.0A)
A5A  A1001 (-3.7A)
 0.69A 6bniB-3wqyA:
11.3		 6bniB-3wqyA:
6.21
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.
6BZO_C_FI8C1201_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		5 / 12 ILE A 300
THR A 319
VAL A 320
VAL A 331
GLU A 335
 None
 1.10A 6bzoC-3wqyA:
undetectable		 6bzoC-3wqyA:
22.52
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.
6FGD_A_ACTA819_0
(GEPHYRIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		3 / 3 ARG A 305
GLY A 302
GLU A 303
 None
 0.63A 6fgdA-3wqyA:
undetectable		 6fgdA-3wqyA:
19.85
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.
6GB9_A_ACTA508_0
(MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN
CNX1)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		3 / 3 VAL A 729
ALA A 621
GLN A 726
 None
 0.68A 6gb9A-3wqyA:
undetectable		 6gb9A-3wqyA:
20.02