SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5e6s'

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_A_DVAA6_0
(GRAMICIDIN A)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 ALA A 349
VAL A 343
TRP A 348
None
0.69A 1bdwA-5e6sA:
undetectable
1bdwB-5e6sA:
undetectable
1bdwA-5e6sA:
1.61
1bdwB-5e6sA:
1.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CQP_A_803A311_1
(ANTIGEN CD11A (P180))
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
6 / 10 LEU A 132
VAL A 233
ILE A 235
TYR A 257
LYS A 287
LEU A 298
None
0.40A 1cqpA-5e6sA:
33.1
1cqpB-5e6sA:
32.9
1cqpA-5e6sA:
100.00
1cqpB-5e6sA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CQP_B_803B311_1
(ANTIGEN CD11A (P180))
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 7 LEU A 132
VAL A 233
TYR A 257
LYS A 287
LEU A 298
None
0.47A 1cqpA-5e6sA:
33.1
1cqpB-5e6sA:
32.9
1cqpA-5e6sA:
100.00
1cqpB-5e6sA:
100.00
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.
1DMA_B_NCAB700_0
(EXOTOXIN A)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 GLY A 494
ALA A 525
TYR A 491
GLU A 545
None
0.73A 1dmaB-5e6sA:
undetectable
1dmaB-5e6sA:
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.
1DYI_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 ILE B 297
ALA B 240
LYS B 335
ILE B 144
LEU B 135
None
1.11A 1dyiB-5e6sB:
undetectable
1dyiB-5e6sB:
15.76
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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 7 LEU A  70
THR A  66
LEU A  90
GLY A  89
None
0.87A 1gtiB-5e6sA:
undetectable
1gtiB-5e6sA:
15.94
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.
1ICR_A_NIOA604_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 SER A 270
THR A 267
GLU A 241
GLY A 240
None
None
None
MG  A2001 ( 4.4A)
1.17A 1icrA-5e6sA:
undetectable
1icrB-5e6sA:
undetectable
1icrA-5e6sA:
14.39
1icrB-5e6sA:
14.39
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.
1ICR_B_NIOB602_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 GLU A 241
GLY A 240
SER A 270
THR A 267
None
MG  A2001 ( 4.4A)
None
None
1.19A 1icrA-5e6sA:
undetectable
1icrB-5e6sA:
undetectable
1icrA-5e6sA:
14.39
1icrB-5e6sA:
14.39
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.
1ICU_A_NIOA221_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 SER A 270
THR A 267
GLU A 241
GLY A 240
None
None
None
MG  A2001 ( 4.4A)
1.16A 1icuA-5e6sA:
undetectable
1icuB-5e6sA:
undetectable
1icuA-5e6sA:
14.39
1icuB-5e6sA:
14.39
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.
1ICU_C_NIOC225_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 SER A 270
THR A 267
GLU A 241
GLY A 240
None
None
None
MG  A2001 ( 4.4A)
1.11A 1icuC-5e6sA:
undetectable
1icuD-5e6sA:
undetectable
1icuC-5e6sA:
14.39
1icuD-5e6sA:
14.39
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.
1ICV_C_NIOC708_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 SER A 270
THR A 267
GLU A 241
GLY A 240
None
None
None
MG  A2001 ( 4.4A)
1.15A 1icvC-5e6sA:
undetectable
1icvD-5e6sA:
undetectable
1icvC-5e6sA:
14.39
1icvD-5e6sA:
14.39
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.
1ICV_D_NIOD706_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 GLU A 241
GLY A 240
SER A 270
THR A 267
None
MG  A2001 ( 4.4A)
None
None
1.19A 1icvC-5e6sA:
undetectable
1icvD-5e6sA:
undetectable
1icvC-5e6sA:
14.39
1icvD-5e6sA:
14.39
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.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 GLU A 241
GLY A 240
SER A 270
THR A 267
None
MG  A2001 ( 4.4A)
None
None
1.17A 1kqbA-5e6sA:
undetectable
1kqbB-5e6sA:
undetectable
1kqbA-5e6sA:
14.63
1kqbB-5e6sA:
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.
1KQB_D_BEZD523_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 GLU A 241
GLY A 240
SER A 270
THR A 267
None
MG  A2001 ( 4.4A)
None
None
1.16A 1kqbC-5e6sA:
undetectable
1kqbD-5e6sA:
undetectable
1kqbC-5e6sA:
14.63
1kqbD-5e6sA:
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.
1QAB_F_RTLF2_0
(PROTEIN (RETINOL
BINDING PROTEIN))
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 ALA A 345
ALA A 349
GLY A 351
PHE A 364
GLN A 422
None
1.08A 1qabF-5e6sA:
undetectable
1qabF-5e6sA:
11.98
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.
1TYR_B_9CRB130_1
(TRANSTHYRETIN)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
4 / 7 THR B  65
ALA B  63
SER B  61
VAL B  81
None
0.99A 1tyrB-5e6sB:
undetectable
1tyrB-5e6sB:
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.
1UAK_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
6 / 12 LEU A 536
SER A 537
PRO A 538
ILE A 471
GLY A 534
GLY A 535
None
1.20A 1uakA-5e6sA:
3.7
1uakA-5e6sA:
17.82
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.
1XF1_A_ACTA1107_0
(C5A PEPTIDASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 LEU A 503
GLY A 562
HIS A 561
ILE A 560
None
0.73A 1xf1A-5e6sA:
2.6
1xf1A-5e6sA:
21.97
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.
1XF1_B_ACTB1108_0
(C5A PEPTIDASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 LEU A 503
GLY A 562
HIS A 561
ILE A 560
None
0.73A 1xf1B-5e6sA:
2.8
1xf1B-5e6sA:
21.97
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 LEU A 394
ASP A 447
ASP A 443
GLY A 448
PHE A 479
None
CA  A2002 (-2.4A)
CA  A2002 (-3.1A)
None
None
0.99A 1zz1B-5e6sA:
undetectable
1zz1C-5e6sA:
undetectable
1zz1B-5e6sA:
18.64
1zz1C-5e6sA:
18.64
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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 LEU A 111
ALA A  75
LEU A 333
SER A  82
ASP A  80
None
1.03A 2c12C-5e6sA:
undetectable
2c12C-5e6sA:
19.98
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.
2C12_F_SPMF1433_1
(NITROALKANE OXIDASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 11 LEU A 111
ALA A  75
LEU A 333
SER A  82
ASP A  80
None
1.02A 2c12F-5e6sA:
undetectable
2c12F-5e6sA:
19.98
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.
2F6D_A_ACRA996_1
(GLUCOAMYLASE GLU1)
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens)
4 / 7 ARG A 495
ASN B 260
ASP B 278
GLY B 283
None
0.87A 2f6dA-5e6sA:
undetectable
2f6dA-5e6sA:
21.27
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.
2F8L_A_SAMA400_0
(HYPOTHETICAL PROTEIN
LMO1582)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 HIS A 427
ALA A 399
GLY A 406
VAL A 374
GLY A 350
None
1.15A 2f8lA-5e6sA:
undetectable
2f8lA-5e6sA:
18.16
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.
2NYR_B_SVRB401_2
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
4 / 6 ARG B 371
GLN B 390
ASN B  94
LEU B  85
None
NAG  B3094 ( 4.5A)
NAG  B3094 (-1.9A)
None
1.00A 2nyrA-5e6sB:
2.2
2nyrA-5e6sB:
19.34
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.
2OKC_B_SAMB500_1
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 THR A  79
THR A  76
ASP A 332
THR A 384
None
1.14A 2okcB-5e6sA:
2.0
2okcB-5e6sA:
21.53
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.
2VDM_B_AGGB1462_1
(INTEGRIN ALPHA-IIB
INTEGRIN BETA-3)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 PHE B 146
TYR B 109
LEU B 237
SER B 116
SER B 114
None
1.30A 2vdmA-5e6sB:
undetectable
2vdmB-5e6sB:
30.6
2vdmA-5e6sB:
22.14
2vdmB-5e6sB:
42.18
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.
2XN5_A_FUNA1356_2
(THYROXINE-BINDING
GLOBULIN)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 LEU A  25
ARG A  23
ILE A  32
None
0.53A 2xn5B-5e6sA:
undetectable
2xn5B-5e6sA:
4.74
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.
2YGO_A_PCFA1213_1
(WNT INHIBITORY
FACTOR 1)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 LEU A 454
ILE A 471
ARG A 532
VAL A   5
None
1.02A 2ygoA-5e6sA:
undetectable
2ygoA-5e6sA:
13.31
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.
2ZW9_B_SAMB801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 8 ILE A 126
ASN A 129
SER A 165
ASP A  95
None
1.09A 2zw9B-5e6sA:
1.4
2zw9B-5e6sA:
21.93
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.
3AI9_X_SAMX501_0
(UPF0217 PROTEIN
MJ1640)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 LEU A 454
ILE A 500
GLY A 456
LEU A 536
GLU A 484
None
1.13A 3ai9X-5e6sA:
3.8
3ai9X-5e6sA:
13.99
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.
3B7P_A_SPMA501_1
(SPERMIDINE SYNTHASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 TYR B 279
HIS B 246
ASP B 209
ASP B 151
ILE B 256
None
None
CA  B2003 (-3.0A)
CA  B2003 (-3.4A)
None
1.25A 3b7pA-5e6sB:
undetectable
3b7pA-5e6sB:
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.
3B7P_B_SPMB502_1
(SPERMIDINE SYNTHASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 TYR B 279
HIS B 246
ASP B 209
ASP B 151
ILE B 256
None
None
CA  B2003 (-3.0A)
CA  B2003 (-3.4A)
None
1.31A 3b7pB-5e6sB:
undetectable
3b7pB-5e6sB:
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.
3B7P_C_SPMC503_1
(SPERMIDINE SYNTHASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 TYR B 279
HIS B 246
ASP B 209
ASP B 151
ILE B 256
None
None
CA  B2003 (-3.0A)
CA  B2003 (-3.4A)
None
1.27A 3b7pC-5e6sB:
undetectable
3b7pC-5e6sB:
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.
3DAT_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 ALA A 499
GLN A  26
VAL A 576
ILE A 528
LEU A   3
None
1.15A 3datA-5e6sA:
undetectable
3datA-5e6sA:
11.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3F78_A_ICFA1_1
(INTEGRIN ALPHA-L)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 ILE A 235
TYR A 257
ILE A 259
LEU A 298
GLU A 301
None
0.87A 3f78A-5e6sA:
34.9
3f78A-5e6sA:
76.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3F78_A_ICFA1_1
(INTEGRIN ALPHA-L)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 ILE A 235
TYR A 257
ILE A 259
LYS A 287
LEU A 298
None
0.38A 3f78A-5e6sA:
34.9
3f78A-5e6sA:
76.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3F78_B_ICFB2_1
(INTEGRIN ALPHA-L)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 ILE A 235
TYR A 257
ILE A 259
LYS A 287
LEU A 298
None
0.34A 3f78B-5e6sA:
35.0
3f78B-5e6sA:
76.69
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 ILE A 560
ALA A   8
ALA A 578
VAL A 526
PRO A 519
None
0.88A 3jb2A-5e6sA:
undetectable
3jb2A-5e6sA:
22.43
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.
3NDV_A_AICA375_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 11 GLY B 142
LEU B 107
LEU B 188
LEU B 131
LEU B 132
None
1.36A 3ndvA-5e6sB:
undetectable
3ndvB-5e6sB:
undetectable
3ndvA-5e6sB:
20.77
3ndvB-5e6sB:
20.77
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.
3NDV_B_AICB376_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 11 LEU B 131
LEU B 132
GLY B 142
LEU B 107
LEU B 188
None
1.37A 3ndvA-5e6sB:
undetectable
3ndvB-5e6sB:
undetectable
3ndvA-5e6sB:
20.77
3ndvB-5e6sB:
20.77
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.
3NDV_C_AICC375_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 11 GLY B 142
LEU B 107
LEU B 188
LEU B 131
LEU B 132
None
1.38A 3ndvC-5e6sB:
undetectable
3ndvD-5e6sB:
undetectable
3ndvC-5e6sB:
20.77
3ndvD-5e6sB:
20.77
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.
3NDV_D_AICD374_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 11 LEU B 131
LEU B 132
GLY B 142
LEU B 107
LEU B 188
None
1.35A 3ndvC-5e6sB:
undetectable
3ndvD-5e6sB:
undetectable
3ndvC-5e6sB:
20.77
3ndvD-5e6sB:
20.77
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.
3NMU_J_SAMJ228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE
NOP5/NOP56 RELATED
PROTEIN)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 11 TYR A  22
GLY A 557
ALA A 578
ILE A 560
ALA A 499
None
1.17A 3nmuB-5e6sA:
undetectable
3nmuJ-5e6sA:
undetectable
3nmuB-5e6sA:
19.05
3nmuJ-5e6sA:
14.36
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.
3OU6_B_SAMB300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 TYR A   1
ASP A 505
ASP A 445
None
CA  A2003 (-3.4A)
None
0.88A 3ou6B-5e6sA:
undetectable
3ou6B-5e6sA:
14.02
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.
3SMT_A_ACTA1001_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
4 / 5 LEU B 215
GLY B 213
PHE B 149
PHE B 239
None
1.16A 3smtA-5e6sB:
undetectable
3smtA-5e6sB:
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.
3W9T_F_W9TF512_1
(HEMOLYTIC LECTIN
CEL-III)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 6 THR A 243
ASN A 207
GLY A 210
ILE A 236
None
0.88A 3w9tF-5e6sA:
undetectable
3w9tF-5e6sA:
18.91
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.
4FGL_C_CLQC303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens;
Homo
sapiens)
4 / 8 GLY A 406
PHE B 247
ILE A 431
PHE B 245
None
0.90A 4fglD-5e6sA:
5.7
4fglD-5e6sA:
15.70
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.
4HYF_A_NCAA1201_0
(TANKYRASE-2)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 7 GLY A 494
ALA A 525
TYR A 491
GLU A 545
None
0.88A 4hyfA-5e6sA:
undetectable
4hyfA-5e6sA:
14.93
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.
4HYF_C_NCAC1201_0
(TANKYRASE-2)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 8 GLY A 494
ALA A 525
TYR A 491
GLU A 545
None
0.90A 4hyfC-5e6sA:
undetectable
4hyfC-5e6sA:
14.93
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.
4J7X_J_SASJ804_1
(SEPIAPTERIN
REDUCTASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 LEU B 333
LEU B 110
PRO B 296
ASP B 242
ASP B 243
None
1.18A 4j7xJ-5e6sB:
3.6
4j7xJ-5e6sB:
19.96
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.
4MMC_A_29JA604_1
(TRANSPORTER)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 7 ILE A 544
PHE A 556
LEU A 585
THR A 501
None
1.07A 4mmcA-5e6sA:
undetectable
4mmcA-5e6sA:
20.86
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.
4MMD_A_29EA603_1
(TRANSPORTER)
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens)
5 / 10 TYR A  69
VAL A 343
ALA A 342
GLY B 254
SER A 101
None
1.27A 4mmdA-5e6sA:
undetectable
4mmdA-5e6sA:
20.86
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.
4N09_C_ADNC401_1
(ADENOSINE KINASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
6 / 12 LEU A 410
GLY A 437
GLY A 436
ALA A 396
LEU A 453
GLY A 377
None
1.15A 4n09C-5e6sA:
undetectable
4n09C-5e6sA:
18.18
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.
4QOG_B_ML1B302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens)
4 / 6 GLY A 406
PHE B 247
ILE A 431
PHE B 245
None
0.88A 4qogA-5e6sA:
5.8
4qogB-5e6sA:
5.9
4qogA-5e6sA:
15.33
4qogB-5e6sA:
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.
4QOP_C_HQEC503_1
(CATALASE)
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens)
4 / 8 ILE A 431
LEU B 311
TYR B 308
LEU B 215
None
0.93A 4qopC-5e6sA:
undetectable
4qopC-5e6sA:
19.63
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.
4R29_D_SAMD301_0
(UNCHARACTERIZED
PROTEIN)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 ALA A 578
GLY A 546
ILE A 528
ALA A 515
GLY A 517
None
1.03A 4r29D-5e6sA:
undetectable
4r29D-5e6sA:
14.00
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.
4WNU_D_QDND602_1
(CYTOCHROME P450 2D6)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 10 GLY A  81
LEU A  25
ALA A  75
ASP A 332
ALA A 338
None
1.35A 4wnuD-5e6sA:
undetectable
4wnuD-5e6sA:
21.40
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.
4XDR_A_ADNA402_1
(FAD:PROTEIN FMN
TRANSFERASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 LEU A   3
ASP A   4
GLY A   7
ALA A   8
VAL A 576
None
0.98A 4xdrA-5e6sA:
undetectable
4xdrA-5e6sA:
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.
4Z3O_F_MFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT
B,PARE30-PARC55
FUSED TOPO IV FROM
S. PNEUMONIAE
E-SITE DNA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 ARG A  18
GLY A  17
GLU A  38
SER A  10
None
1.09A 4z3oA-5e6sA:
undetectable
4z3oB-5e6sA:
2.2
4z3oA-5e6sA:
22.68
4z3oB-5e6sA:
22.68
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.
4ZBR_A_ACTA608_0
(SERUM ALBUMIN)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
3 / 3 LYS B 272
ARG B 273
HIS B 265
None
1.10A 4zbrA-5e6sB:
undetectable
4zbrA-5e6sB:
21.76
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.
5ALB_L_TIQL1210_2
(MEDI2452 LIGHT CHAIN)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 8 SER A 330
GLY A 341
ALA A 376
GLY A 350
None
0.68A 5albL-5e6sA:
undetectable
5albL-5e6sA:
14.21
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.
5AXA_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 GLU A 180
THR A 206
HIS A 264
LEU A 142
None
MG  A2001 (-4.3A)
None
None
1.27A 5axaA-5e6sA:
3.7
5axaA-5e6sA:
20.50
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.
5AXA_C_ADNC502_2
(ADENOSYLHOMOCYSTEINA
SE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 GLU A 180
THR A 206
HIS A 264
LEU A 142
None
MG  A2001 (-4.3A)
None
None
1.27A 5axaC-5e6sA:
3.5
5axaC-5e6sA:
20.50
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.
5BTF_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 7 SER A  10
ARG A  18
GLY A  17
GLU A  38
None
1.07A 5btfA-5e6sA:
undetectable
5btfC-5e6sA:
undetectable
5btfD-5e6sA:
undetectable
5btfA-5e6sA:
22.07
5btfC-5e6sA:
22.07
5btfD-5e6sA:
15.85
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.
5CDQ_E_MFXE2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 SER A  10
ARG A  18
GLY A  17
GLU A  38
None
1.18A 5cdqA-5e6sA:
undetectable
5cdqB-5e6sA:
2.5
5cdqC-5e6sA:
undetectable
5cdqA-5e6sA:
20.76
5cdqB-5e6sA:
12.06
5cdqC-5e6sA:
20.76
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.
5CDQ_V_MFXV2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 5 SER A  10
ARG A  18
GLY A  17
GLU A  38
None
1.17A 5cdqR-5e6sA:
undetectable
5cdqS-5e6sA:
2.5
5cdqT-5e6sA:
undetectable
5cdqR-5e6sA:
20.76
5cdqS-5e6sA:
12.06
5cdqT-5e6sA:
20.76
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
4 / 5 VAL B 124
VAL B 199
GLY B 200
PHE B 195
None
1.09A 5d4nA-5e6sB:
undetectable
5d4nC-5e6sB:
undetectable
5d4nA-5e6sB:
13.68
5d4nC-5e6sB:
13.68
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.
5EB5_A_010A609_0
(HNL ISOENZYME 5)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 11 ALA B  91
ALA B  63
VAL B  81
LEU B 356
VAL B 417
None
1.14A 5eb5A-5e6sB:
1.4
5eb5A-5e6sB:
22.50
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.
5EB5_B_010B607_0
(HNL ISOENZYME 5)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 10 ALA B  91
ALA B  63
VAL B  81
LEU B 356
VAL B 417
None
1.10A 5eb5B-5e6sB:
undetectable
5eb5B-5e6sB:
22.50
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.
5EWZ_B_BEZB301_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.88A 5ewzB-5e6sA:
undetectable
5ewzB-5e6sA:
14.64
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.
5G5G_C_ACTC1740_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
4 / 4 VAL A 444
GLU A 451
GLY A 535
LEU A 536
None
CA  A2002 (-3.0A)
None
None
1.01A 5g5gC-5e6sA:
undetectable
5g5gC-5e6sA:
23.43
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.
5IEN_A_VDYA201_2
(CDL2.2)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 VAL A  58
ILE A  83
LEU A 111
PRO A  57
LEU A 359
None
1.14A 5ienA-5e6sA:
undetectable
5ienA-5e6sA:
9.77
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.
5IEN_B_VDYB201_1
(CDL2.2)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 10 VAL A  58
ILE A  83
LEU A 111
PRO A  57
LEU A 359
None
1.12A 5ienB-5e6sA:
undetectable
5ienB-5e6sA:
9.77
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.
5IMS_B_ACTB713_0
(ACETOLACTATE
SYNTHASE CATALYTIC
SUBUNIT,
MITOCHONDRIAL)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
3 / 3 GLY B 262
GLN B 220
LYS B 288
None
0.98A 5imsB-5e6sB:
2.6
5imsB-5e6sB:
22.89
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.
5M35_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.80A 5m35B-5e6sA:
undetectable
5m35B-5e6sA:
14.98
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.
5M36_A_BEZA303_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.79A 5m36A-5e6sA:
undetectable
5m36A-5e6sA:
14.98
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.
5NUN_A_Z80A201_1
(BETA-LACTOGLOBULIN)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
6 / 9 ALA B  91
VAL B 393
ILE B 406
ASN B  94
PHE B  93
ALA B  63
None
None
None
NAG  B3094 (-1.9A)
None
None
1.21A 5nunA-5e6sB:
undetectable
5nunA-5e6sB:
9.02
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.
5VOO_A_C2FA3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
0.99A 5vooA-5e6sB:
undetectable
5vooA-5e6sB:
22.00
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.
5VOO_B_C2FB702_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.00A 5vooB-5e6sB:
undetectable
5vooB-5e6sB:
22.00
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.
5VOO_C_C2FC702_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.01A 5vooC-5e6sB:
undetectable
5vooC-5e6sB:
22.00
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.
5VOO_D_C2FD3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.01A 5vooD-5e6sB:
2.6
5vooD-5e6sB:
22.00
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.
5VOO_E_C2FE3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 12 GLY A 517
MET A 582
VAL A  31
LEU A  25
GLY A 562
None
1.14A 5vooE-5e6sA:
undetectable
5vooE-5e6sA:
15.97
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.
5VOO_E_C2FE3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
ASP B 209
GLY B 206
SER B 114
None
None
CA  B2003 (-3.0A)
None
None
1.20A 5vooE-5e6sB:
undetectable
5vooE-5e6sB:
22.00
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.
5VOO_E_C2FE3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.08A 5vooE-5e6sB:
undetectable
5vooE-5e6sB:
22.00
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.
5VOO_F_C2FF3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
ASP B 209
GLY B 206
SER B 114
None
None
CA  B2003 (-3.0A)
None
None
1.18A 5vooF-5e6sB:
2.5
5vooF-5e6sB:
22.00
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.
5VOO_F_C2FF3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.06A 5vooF-5e6sB:
2.5
5vooF-5e6sB:
22.00
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.
5VOP_A_C2FA3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.04A 5vopA-5e6sB:
undetectable
5vopA-5e6sB:
22.00
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.
5VOP_B_C2FB3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
5 / 12 GLU B 212
GLY B 213
LEU B 165
GLY B 206
SER B 114
None
1.12A 5vopB-5e6sB:
undetectable
5vopB-5e6sB:
22.00
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.
5X6Y_C_SAMC902_0
(MRNA CAPPING ENZYME
P5)
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens;
Homo
sapiens)
5 / 12 GLY B 213
PRO B 211
HIS A 404
ASP B 151
PHE B 182
None
None
None
CA  B2003 (-3.4A)
None
1.10A 5x6yC-5e6sB:
undetectable
5x6yC-5e6sB:
19.29
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.
5ZNI_A_YMZA302_0
(PURINE NUCLEOSIDE
PHOSPHORYLASE)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 GLY A 328
VAL A 340
ASP A  87
GLY A 102
PRO A 120
None
1.34A 5zniA-5e6sA:
undetectable
5zniA-5e6sA:
6.97
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.
6AWO_A_SREA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 ASP A 249
ALA A 211
ILE A 212
GLY A 246
PHE A 209
None
1.22A 6awoA-5e6sA:
undetectable
6awoA-5e6sA:
20.91
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.
6AWQ_A_SREA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
5 / 9 ASP A 249
ALA A 211
ILE A 212
GLY A 246
PHE A 209
None
1.22A 6awqA-5e6sA:
undetectable
6awqA-5e6sA:
20.91
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.
6B58_A_ACTA606_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)
5e6s INTEGRIN BETA-2
(Homo
sapiens)
4 / 5 GLU B 276
ASP B 261
HIS B 265
THR B 258
None
1.35A 6b58A-5e6sB:
undetectable
6b58A-5e6sB:
20.98
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.
6FN9_A_BEZA302_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.78A 6fn9A-5e6sA:
undetectable
6fn9A-5e6sA:
14.64
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.
6FNA_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.79A 6fnaB-5e6sA:
undetectable
6fnaB-5e6sA:
14.64
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.
6FNB_A_BEZA301_0
(14-3-3 PROTEIN
ZETA/DELTA)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 MET A 405
GLN A 403
ARG A 407
None
0.78A 6fnbA-5e6sA:
undetectable
6fnbA-5e6sA:
14.64
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.
6NKN_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
5e6s INTEGRIN ALPHA-L
(Homo
sapiens)
3 / 3 ARG A 474
LEU A 394
PHE A 411
None
0.76A 6nknP-5e6sA:
undetectable
6nknP-5e6sA:
14.61
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.
6QXS_B_FOZB403_0
(THYMIDYLATE SYNTHASE)
5e6s INTEGRIN ALPHA-L
INTEGRIN BETA-2

(Homo
sapiens;
Homo
sapiens)
5 / 12 PRO B 156
LEU B 253
ILE A 329
LEU A  84
GLY A 102
None
1.05A 6qxsB-5e6sB:
undetectable
6qxsB-5e6sB:
19.96