SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4xwh'

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.
1BDW_B_DVAB6_0
(GRAMICIDIN A)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 TRP A 540
ALA A 493
VAL A 536
 None
 0.76A 1bdwA-4xwhA:
undetectable
1bdwB-4xwhA:
undetectable		 1bdwA-4xwhA:
2.26
1bdwB-4xwhA:
2.26
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.
1CBR_A_REAA200_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
TYPE I)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 PHE A 288
LEU A 296
ALA A 337
ALA A 333
TYR A 326
 None
 1.17A 1cbrA-4xwhA:
undetectable		 1cbrA-4xwhA:
11.91
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.
1CBR_B_REAB200_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
TYPE I)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 PHE A 288
LEU A 296
ALA A 337
ALA A 333
TYR A 326
 None
 1.17A 1cbrB-4xwhA:
undetectable		 1cbrB-4xwhA:
11.91
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.
1EII_A_RTLA135_1
(CELLULAR
RETINOL-BINDING
PROTEIN II)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 7 GLN A 138
THR A 137
TRP A 621
GLN A 645
 None
 1.49A 1eiiA-4xwhA:
undetectable		 1eiiA-4xwhA:
10.14
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.
1GYX_A_BEZA1077_0
(HYPOTHETICAL PROTEIN
YDCE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 7 PHE A 198
TRP A 649
TYR A 140
SER A 139
 None
XYL  A2015 ( 4.7A)
XYL  A2015 (-4.6A)
None
 1.21A 1gyxA-4xwhA:
undetectable
1gyxB-4xwhA:
undetectable		 1gyxA-4xwhA:
7.73
1gyxB-4xwhA:
7.73
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.
1HK2_A_T44A3002_1
(SERUM ALBUMIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 8 GLN A 357
LEU A 353
TYR A 326
LEU A 280
 None
 1.25A 1hk2A-4xwhA:
2.7		 1hk2A-4xwhA:
22.11
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.
1KQE_A_DVAA6_0
(MINI-GRAMICIDIN A)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ALA A 480
VAL A 475
TRP A 474
 None
 0.89A 1kqeA-4xwhA:
undetectable
1kqeE-4xwhA:
undetectable		 1kqeA-4xwhA:
1.77
1kqeE-4xwhA:
1.77
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.
1KQE_B_DVAB6_0
(MINI-GRAMICIDIN A)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ALA A 480
VAL A 475
TRP A 474
 None
 0.87A 1kqeB-4xwhA:
undetectable
1kqeD-4xwhA:
undetectable		 1kqeB-4xwhA:
1.77
1kqeD-4xwhA:
1.77
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.
1KQE_D_DVAD6_0
(MINI-GRAMICIDIN A)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 TRP A 474
ALA A 480
VAL A 475
 None
 0.89A 1kqeB-4xwhA:
undetectable
1kqeD-4xwhA:
undetectable		 1kqeB-4xwhA:
1.77
1kqeD-4xwhA:
1.77
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.
1KQE_E_DVAE6_0
(MINI-GRAMICIDIN A)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 TRP A 474
ALA A 480
VAL A 475
 None
 0.87A 1kqeA-4xwhA:
undetectable
1kqeE-4xwhA:
undetectable		 1kqeA-4xwhA:
1.77
1kqeE-4xwhA:
1.77
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.
1MOG_A_RBFA200_1
(DODECIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 PHE A 410
TRP A 352
GLU A 316
 None
GOL  A2011 ( 3.7A)
XYL  A2015 ( 2.9A)
 1.09A 1mogA-4xwhA:
undetectable		 1mogA-4xwhA:
9.43
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.
1NP1_A_HSMA303_1
(NITROPHORIN 1)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 5 ASP A 607
LEU A 663
LEU A 618
LEU A 610
 None
 1.05A 1np1A-4xwhA:
undetectable		 1np1A-4xwhA:
12.96
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.
1QW6_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ARG A 149
VAL A 101
TRP A 156
 None
 1.23A 1qw6A-4xwhA:
undetectable		 1qw6A-4xwhA:
19.30
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.
1QWC_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ARG A 149
VAL A 101
TRP A 156
 None
 1.26A 1qwcA-4xwhA:
undetectable		 1qwcA-4xwhA:
19.30
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.
1TDN_A_LEUA487_0
(L-AMINO ACID OXIDASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 7 ASN A 413
HIS A 512
TYR A 140
ILE A 655
 None
None
XYL  A2015 (-4.6A)
XYL  A2015 ( 4.2A)
 1.40A 1tdnA-4xwhA:
undetectable		 1tdnA-4xwhA:
21.47
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.
1U18_A_HSMA401_1
(NITROPHORIN 1)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 4 ASP A 607
LEU A 663
LEU A 618
LEU A 610
 None
 1.09A 1u18A-4xwhA:
undetectable		 1u18A-4xwhA:
12.96
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.
1VAG_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ARG A 149
VAL A 101
TRP A 156
 None
 1.19A 1vagA-4xwhA:
undetectable		 1vagA-4xwhA:
19.30
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.
1YAJ_K_BEZK4387_0
(CES1 PROTEIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 TRP A 649
LEU A 646
LYS A 661
 XYL  A2015 ( 4.7A)
None
None
 1.46A 1yajK-4xwhA:
undetectable		 1yajK-4xwhA:
22.18
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.
1ZVI_A_H4BA901_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ARG A 149
VAL A 101
TRP A 156
 None
 1.22A 1zviA-4xwhA:
undetectable		 1zviA-4xwhA:
19.30
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.
2AOI_C_FRDC305_1
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 5 GLY A 183
PRO A 250
VAL A 249
ILE A 291
 None
 1.00A 2aoiA-4xwhA:
undetectable		 2aoiA-4xwhA:
8.40
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)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 THR A 263
PRO A 283
TYR A 326
 None
NAG  A2004 (-4.3A)
None
 0.78A 2dxrA-4xwhA:
undetectable		 2dxrA-4xwhA:
17.97
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.
2IGT_A_SAMA1001_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 ASP A 613
ASP A 722
ASP A 559
 None
 0.69A 2igtA-4xwhA:
undetectable		 2igtA-4xwhA:
18.61
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.
2R5Q_B_1UNB900_1
(PROTEASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 9 LEU A 281
GLY A 183
PRO A 250
VAL A 249
ILE A 291
 None
 1.13A 2r5qA-4xwhA:
undetectable		 2r5qA-4xwhA:
8.24
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.
2R5Q_D_1UND900_1
(PROTEASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 9 LEU A 281
GLY A 183
PRO A 250
VAL A 249
ILE A 291
 None
 1.13A 2r5qC-4xwhA:
undetectable		 2r5qC-4xwhA:
8.24
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 GLN A 171
THR A 194
TRP A 201
 None
None
XYL  A2015 (-3.6A)
 1.06A 2rctA-4xwhA:
undetectable		 2rctA-4xwhA:
10.89
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 GLN A 624
THR A 137
TRP A 103
 None
 0.96A 2rctA-4xwhA:
undetectable		 2rctA-4xwhA:
10.89
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.
2ZI9_B_CL9B401_1
(DEOXYCYTIDINE KINASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 ILE A 448
TYR A 132
ARG A 482
ARG A 149
GLU A 153
 None
 1.24A 2zi9B-4xwhA:
0.0		 2zi9B-4xwhA:
15.59
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.
3B0W_A_DGXA1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 LEU A 299
LEU A 296
ALA A 244
CYH A 405
LEU A 383
 None
 1.29A 3b0wA-4xwhA:
undetectable		 3b0wA-4xwhA:
15.58
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.
3CCF_A_BEZA261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 8 HIS A 248
GLY A 205
ASN A 206
PHE A 314
 None
 1.40A 3ccfA-4xwhA:
undetectable		 3ccfA-4xwhA:
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.
3CSJ_B_CBLB211_0
(GLUTATHIONE
S-TRANSFERASE P)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 9 PRO A 445
GLY A 511
ARG A 510
TYR A 658
GLY A 411
 None
None
None
XYL  A2015 (-3.4A)
None
 1.49A 3csjB-4xwhA:
undetectable		 3csjB-4xwhA:
14.44
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_V_DR7V100_2
(PROTEASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 10 ASP A 382
ILE A 403
GLY A 442
LEU A 461
PRO A 126
 None
 1.02A 3em4V-4xwhA:
undetectable		 3em4V-4xwhA:
8.70
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.
3IB0_A_DIFA701_1
(LACTOTRANSFERRIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 4 PRO A 215
TYR A 638
GLY A 195
THR A 194
 None
 1.40A 3ib0A-4xwhA:
undetectable		 3ib0A-4xwhA:
17.97
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.
3ITA_D_AICD501_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		3 / 3 PRO A 389
PHE A 402
ALA A 430
 None
 0.68A 3itaD-4xwhA:
undetectable		 3itaD-4xwhA:
18.66
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.
3JWQ_C_VIAC901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
CATALYTIC DOMAIN,
CONE CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
SUBUNIT ALPHA
CHIMERA)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 7 HIS A 408
LEU A 563
GLN A 566
VAL A 518
 None
 1.11A 3jwqC-4xwhA:
undetectable		 3jwqC-4xwhA:
17.10
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.
3PGH_A_FLPA701_1
(CYCLOOXYGENASE-2)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 VAL A 667
VAL A 568
LEU A 571
LEU A 517
ALA A 605
 None
 1.32A 3pghA-4xwhA:
undetectable		 3pghA-4xwhA:
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.
3UR0_C_SVRC516_1
(RNA-DEPENDENT RNA
POLYMERASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 9 PRO A 488
GLY A 491
ALA A 490
TRP A 494
ALA A 539
 None
 1.48A 3ur0C-4xwhA:
undetectable		 3ur0C-4xwhA:
20.68
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.
3UR0_C_SVRC516_1
(RNA-DEPENDENT RNA
POLYMERASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 9 PRO A 488
GLY A 491
ALA A 490
TRP A 494
LEU A 550
 None
 1.46A 3ur0C-4xwhA:
undetectable		 3ur0C-4xwhA:
20.68
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.
3V35_A_NTIA317_1
(ALDOSE REDUCTASE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 8 VAL A 454
HIS A 408
PRO A 427
TRP A 404
 None
 1.47A 3v35A-4xwhA:
4.1		 3v35A-4xwhA:
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.
3VKX_A_T3A301_1
(PROLIFERATING CELL
NUCLEAR ANTIGEN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 6 MET A 233
LEU A 230
PRO A 243
GLN A 171
 None
 1.35A 3vkxA-4xwhA:
undetectable		 3vkxA-4xwhA:
16.34
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.
3VYW_A_SAMA501_1
(MNMC2)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 6 HIS A 512
GLU A 316
ASP A 312
ASN A 134
 None
XYL  A2015 ( 2.9A)
None
GOL  A2011 (-3.0A)
 1.24A 3vywA-4xwhA:
undetectable		 3vywA-4xwhA:
18.12
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.
4MFL_B_GCSB502_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN TCP24
TEICOPLANIN
PSEUDOAGLYCONE)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 6 MET A 157
TRP A 156
ALA A 444
PHE A 142
 None
 1.26A 4mflA-4xwhA:
0.0		 4mflA-4xwhA:
19.28
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.
4ZZC_E_ACTE406_0
(PROTON-GATED ION
CHANNEL)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 5 ILE A 162
ILE A 154
TYR A 132
GLU A 153
 None
 1.23A 4zzcE-4xwhA:
5.5		 4zzcE-4xwhA:
17.93
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.
5LJB_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 8 LEU A 622
LEU A 666
ILE A 448
TRP A 145
 None
 1.04A 5ljbA-4xwhA:
undetectable		 5ljbA-4xwhA:
11.25
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.
5M0I_B_ACTB303_0
(SWI5-DEPENDENT HO
EXPRESSION PROTEIN 2)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 5 VAL A 609
THR A 564
ASP A 562
LEU A 561
 None
 1.22A 5m0iB-4xwhA:
3.3		 5m0iB-4xwhA:
15.89
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.
5SYE_B_TA1B502_1
(TUBULIN BETA CHAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 VAL A 117
LEU A  40
ASP A  47
GLN A 107
ARG A  91
 None
 1.08A 5syeB-4xwhA:
undetectable		 5syeB-4xwhA:
21.37
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.
5UNX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		4 / 7 MET A 157
ARG A 149
VAL A 101
TRP A 156
 None
 1.38A 5unxA-4xwhA:
2.5
5unxB-4xwhA:
undetectable		 5unxA-4xwhA:
19.26
5unxB-4xwhA:
19.26
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.
5X6Y_A_SAMA902_0
(MRNA CAPPING ENZYME
P5)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 LEU A 349
ALA A 311
PRO A 283
GLU A 284
THR A 332
 None
None
NAG  A2004 (-4.3A)
None
None
 1.21A 5x6yA-4xwhA:
undetectable		 5x6yA-4xwhA:
22.56
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.
5X6Y_C_SAMC902_0
(MRNA CAPPING ENZYME
P5)		 4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE
(Homo
sapiens) 		5 / 12 LEU A 349
ALA A 311
PRO A 283
GLU A 284
THR A 332
 None
None
NAG  A2004 (-4.3A)
None
None
 1.28A 5x6yC-4xwhA:
undetectable		 5x6yC-4xwhA:
22.56