SIMILAR PATTERNS OF AMINO ACIDS FOR 3B7P_A_SPMA501

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1ems NIT-FRAGILE
HISTIDINE TRIAD
FUSION PROTEIN

(Caenorhabditis
elegans) 		PF00795
(CN_hydrolase)
PF01230
(HIT) 		5 TYR A 125
ASP A 171
GLU A 291
PRO A 156
ILE A 154
 None
 1.46A 3b7pA-1emsA:
undetectable		 3b7pA-1emsA:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fvf SEC1

(Doryteuthis
pealeii) 		PF00995
(Sec1) 		5 HIS A 500
ASP A 497
GLU A 489
TYR A 483
ILE A 487
 None
 1.39A 3b7pA-1fvfA:
3.5		 3b7pA-1fvfA:
18.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1inl SPERMIDINE SYNTHASE

(Thermotoga
maritima) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 TYR A  76
HIS A  77
ASP A 101
ASP A 170
TYR A 239
PRO A 240
 None
 0.32A 3b7pA-1inlA:
37.6		 3b7pA-1inlA:
37.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iy9 SPERMIDINE SYNTHASE

(Bacillus
subtilis) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A 189
HIS A  63
TYR A 224
PRO A 225
ILE A 221
 None
 1.43A 3b7pA-1iy9A:
36.6		 3b7pA-1iy9A:
39.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iy9 SPERMIDINE SYNTHASE

(Bacillus
subtilis) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 HIS A  63
ASP A  87
TYR A 224
PRO A 225
ILE A 221
 None
 1.47A 3b7pA-1iy9A:
36.6		 3b7pA-1iy9A:
39.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1iy9 SPERMIDINE SYNTHASE

(Bacillus
subtilis) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A  62
HIS A  63
ASP A  87
TYR A 224
PRO A 225
 None
 0.47A 3b7pA-1iy9A:
36.6		 3b7pA-1iy9A:
39.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 GLN A  51
TYR A  60
HIS A  61
ASP A  85
ASP A 158
ASP A 161
GLN A 191
TYR A 226
 None
 0.48A 3b7pA-1mjfA:
36.6		 3b7pA-1mjfA:
35.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r5m SIR4-INTERACTING
PROTEIN SIF2

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 GLN A 501
TYR A 525
ASP A 505
ASP A 463
ILE A 509
 None
 1.49A 3b7pA-1r5mA:
2.3		 3b7pA-1r5mA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tye INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 TYR B 289
HIS B 255
ASP B 217
ASP B 158
ILE B 265
 None
None
CA  B1403 ( 2.8A)
CA  B1403 (-3.0A)
None
 1.30A 3b7pA-1tyeB:
undetectable		 3b7pA-1tyeB:
18.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 TRP A  55
GLN A  97
TYR A 106
ASP A 131
GLN A 234
TYR A 270
PRO A 271
ILE A 275
 None
 0.76A 3b7pA-1xj5A:
42.8		 3b7pA-1xj5A:
46.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 TRP A  55
GLN A  97
TYR A 106
ASP A 204
GLN A 234
TYR A 270
PRO A 271
ILE A 275
 None
 0.76A 3b7pA-1xj5A:
42.8		 3b7pA-1xj5A:
46.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 TRP A  55
TYR A 106
ASP A 131
ASP A 201
GLN A 234
TYR A 270
PRO A 271
ILE A 275
 None
 0.71A 3b7pA-1xj5A:
42.8		 3b7pA-1xj5A:
46.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 TRP A  55
TYR A 106
ASP A 201
ASP A 204
GLN A 234
TYR A 270
PRO A 271
ILE A 275
 None
 0.65A 3b7pA-1xj5A:
42.8		 3b7pA-1xj5A:
46.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2b2c SPERMIDINE SYNTHASE

(Caenorhabditis
elegans) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A  95
HIS A 100
ASP A 119
GLU A 139
ILE A 114
 None
 1.38A 3b7pA-2b2cA:
37.8		 3b7pA-2b2cA:
45.86
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.
2j7a CYTOCHROME C NITRITE
REDUCTASE NRFA

(Desulfovibrio
vulgaris) 		PF02335
(Cytochrom_C552) 		5 TYR A  64
ASP A  68
ASP A 182
GLU A  47
TYR A  61
 HEM  A1002 (-3.7A)
None
None
None
HEM  A1002 ( 4.4A)
 1.13A 3b7pA-2j7aA:
undetectable		 3b7pA-2j7aA:
19.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLN A 229
HIS A 103
ASP A 196
TYR A 264
PRO A 265
ILE A 261
 None
S4M  A 501 (-3.7A)
S4M  A 501 (-2.6A)
None
None
None
 1.45A 3b7pA-2pt6A:
51.0		 3b7pA-2pt6A:
93.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		11 TRP A  51
GLN A  93
TYR A 102
HIS A 103
ASP A 127
ASP A 196
ASP A 199
GLN A 229
TYR A 264
PRO A 265
ILE A 269
 None
S4M  A 501 (-4.1A)
S4M  A 501 (-4.9A)
S4M  A 501 (-3.7A)
S4M  A 501 (-2.9A)
S4M  A 501 (-2.6A)
None
None
None
None
None
 0.26A 3b7pA-2pt6A:
51.0		 3b7pA-2pt6A:
93.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A 102
HIS A 103
ASP A 127
ASP A 196
ILE A 259
 S4M  A 501 (-4.9A)
S4M  A 501 (-3.7A)
S4M  A 501 (-2.9A)
S4M  A 501 (-2.6A)
None
 1.43A 3b7pA-2pt6A:
51.0		 3b7pA-2pt6A:
93.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 GLN A  53
TYR A  62
HIS A  63
ASP A  87
ASP A 161
ASP A 164
GLN A 194
TYR A 229
 AG3  A1001 (-3.2A)
AG3  A1001 (-4.5A)
AG3  A1001 (-4.0A)
AG3  A1001 (-3.0A)
AG3  A1001 (-2.8A)
AG3  A1001 (-3.0A)
AG3  A1001 ( 4.1A)
AG3  A1001 (-3.7A)
 0.49A 3b7pA-2zsuA:
37.5		 3b7pA-2zsuA:
36.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3anx SPERMIDINE SYNTHASE

(Thermus
thermophilus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A  54
TYR A  63
HIS A  64
ASP A 158
GLN A 194
 MTA  A 315 (-2.4A)
None
None
MTA  A 315 (-4.9A)
None
 0.87A 3b7pA-3anxA:
35.6		 3b7pA-3anxA:
30.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3anx SPERMIDINE SYNTHASE

(Thermus
thermophilus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A  54
TYR A  63
HIS A  64
ASP A 158
ILE A 227
 MTA  A 315 (-2.4A)
None
None
MTA  A 315 (-4.9A)
None
 1.33A 3b7pA-3anxA:
35.6		 3b7pA-3anxA:
30.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3anx SPERMIDINE SYNTHASE

(Thermus
thermophilus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A  63
HIS A  64
ASP A 158
ASP A 161
GLN A 194
 None
None
MTA  A 315 (-4.9A)
None
None
 1.00A 3b7pA-3anxA:
35.6		 3b7pA-3anxA:
30.67
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.
3c6m SPERMINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A 177
ASP A 201
ASP A 276
ASP A 167
TYR A 351
 SPM  A 501 (-4.2A)
SPM  A 501 ( 3.8A)
SPM  A 501 ( 3.2A)
SPM  A 501 (-3.1A)
SPM  A 501 (-3.5A)
 1.02A 3b7pA-3c6mA:
25.6		 3b7pA-3c6mA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c6m SPERMINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A 177
ASP A 201
ASP A 276
GLN A 315
TYR A 351
 SPM  A 501 (-4.2A)
SPM  A 501 ( 3.8A)
SPM  A 501 ( 3.2A)
SPM  A 501 ( 4.0A)
SPM  A 501 (-3.5A)
 0.73A 3b7pA-3c6mA:
25.6		 3b7pA-3c6mA:
20.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o4f SPERMIDINE SYNTHASE

(Escherichia
coli) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A  54
HIS A  64
ASP A  88
GLN A 191
GLU A 201
 None
 1.39A 3b7pA-3o4fA:
34.4		 3b7pA-3o4fA:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o4f SPERMIDINE SYNTHASE

(Escherichia
coli) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLN A  54
TYR A  63
ASP A  88
ASP A 158
GLN A 191
TYR A 226
 None
 1.23A 3b7pA-3o4fA:
34.4		 3b7pA-3o4fA:
37.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o4f SPERMIDINE SYNTHASE

(Escherichia
coli) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLN A  54
TYR A  63
HIS A  64
ASP A  88
GLN A 191
TYR A 226
 None
 0.69A 3b7pA-3o4fA:
34.4		 3b7pA-3o4fA:
37.70
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.
3pz9 MANNAN
ENDO-1,4-BETA-MANNOS
IDASE. GLYCOSYL
HYDROLASE FAMILY 5

(Thermotoga
petrophila) 		PF00150
(Cellulase) 		5 TYR A 184
HIS A 175
ASP A 113
PRO A 188
ILE A 190
 None
 1.42A 3b7pA-3pz9A:
undetectable		 3b7pA-3pz9A:
24.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A  70
ASP A 104
TYR A 241
PRO A 242
ILE A 238
 DSH  A 303 (-4.1A)
DSH  A 303 (-3.3A)
None
None
None
 1.47A 3b7pA-3rw9A:
41.9		 3b7pA-3rw9A:
42.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		7 GLN A  70
TYR A  79
ASP A 104
ASP A 173
GLU A 208
TYR A 241
ILE A 246
 DSH  A 303 (-4.1A)
DSH  A 303 ( 4.9A)
DSH  A 303 (-3.3A)
DSH  A 303 (-3.0A)
None
None
None
 1.04A 3b7pA-3rw9A:
41.9		 3b7pA-3rw9A:
42.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A 206
ASP A 173
TYR A 241
PRO A 242
ILE A 238
 None
DSH  A 303 (-3.0A)
None
None
None
 1.42A 3b7pA-3rw9A:
41.9		 3b7pA-3rw9A:
42.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		9 TRP A  28
GLN A  70
TYR A  79
ASP A 104
ASP A 173
GLN A 206
TYR A 241
PRO A 242
ILE A 246
 None
DSH  A 303 (-4.1A)
DSH  A 303 ( 4.9A)
DSH  A 303 (-3.3A)
DSH  A 303 (-3.0A)
None
None
None
None
 0.64A 3b7pA-3rw9A:
41.9		 3b7pA-3rw9A:
42.90
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.
4d1d HYDANTOIN TRANSPORT
PROTEIN

(Microbacterium
liquefaciens) 		PF02133
(Transp_cyt_pur) 		5 GLN A 245
TYR A 381
ASP A 249
GLU A 459
ILE A 389
 None
 1.47A 3b7pA-4d1dA:
undetectable		 3b7pA-4d1dA:
19.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A 229
ASP A 196
TYR A 264
PRO A 265
ILE A 261
 4ZY  A 501 (-4.2A)
4ZY  A 501 ( 3.6A)
4ZY  A 501 (-3.4A)
None
None
 1.43A 3b7pA-4uoeA:
51.1		 3b7pA-4uoeA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 HIS A 103
ASP A 196
TYR A 264
PRO A 265
ILE A 261
 None
4ZY  A 501 ( 3.6A)
4ZY  A 501 (-3.4A)
None
None
 1.33A 3b7pA-4uoeA:
51.1		 3b7pA-4uoeA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		11 TRP A  51
GLN A  93
TYR A 102
HIS A 103
ASP A 127
ASP A 196
ASP A 199
GLN A 229
TYR A 264
PRO A 265
ILE A 269
 None
4ZY  A 501 ( 3.6A)
4ZY  A 501 (-4.3A)
None
MTA  A 401 (-4.3A)
4ZY  A 501 ( 3.6A)
4ZY  A 501 (-2.5A)
4ZY  A 501 (-4.2A)
4ZY  A 501 (-3.4A)
None
4ZY  A 501 ( 4.7A)
 0.26A 3b7pA-4uoeA:
51.1		 3b7pA-4uoeA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A 102
HIS A 103
ASP A 127
ASP A 196
ILE A 259
 4ZY  A 501 (-4.3A)
None
MTA  A 401 (-4.3A)
4ZY  A 501 ( 3.6A)
None
 1.46A 3b7pA-4uoeA:
51.1		 3b7pA-4uoeA:
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.
4up7 LYSINE--TRNA LIGASE

(Entamoeba
histolytica) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 GLN A 451
HIS A 462
ASP A 450
GLU A 229
PRO A 457
 None
None
None
LAD  A1584 (-3.6A)
None
 1.40A 3b7pA-4up7A:
undetectable		 3b7pA-4up7A:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x8d SULFOXIDE SYNTHASE
EGTB

(Mycolicibacterium
thermoresistibile) 		PF03781
(FGE-sulfatase)
PF12867
(DinB_2) 		5 TRP A 361
GLN A 422
ASP A  39
ASP A 416
ILE A 419
 None
None
None
3GC  A 501 (-2.8A)
CL  A 512 ( 4.1A)
 1.20A 3b7pA-4x8dA:
undetectable		 3b7pA-4x8dA:
19.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 GLN A  64
TYR A  73
HIS A  74
ASP A  98
ASP A 168
GLN A 201
TYR A 237
PRO A 238
 S4M  A 301 (-4.2A)
S4M  A 301 (-4.4A)
S4M  A 301 (-4.0A)
S4M  A 301 (-3.1A)
S4M  A 301 (-3.1A)
None
None
None
 0.76A 3b7pA-4yv2A:
38.0		 3b7pA-4yv2A:
42.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		8 GLN A  64
TYR A  73
HIS A  74
ASP A  98
ASP A 168
TYR A 237
PRO A 238
ILE A 242
 S4M  A 301 (-4.2A)
S4M  A 301 (-4.4A)
S4M  A 301 (-4.0A)
S4M  A 301 (-3.1A)
S4M  A 301 (-3.1A)
None
None
None
 0.57A 3b7pA-4yv2A:
38.0		 3b7pA-4yv2A:
42.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLN A 201
HIS A  74
ASP A 168
TYR A 237
PRO A 238
 None
S4M  A 301 (-4.0A)
S4M  A 301 (-3.1A)
None
None
 1.33A 3b7pA-4yv2A:
38.0		 3b7pA-4yv2A:
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.
5c92 KELCH
DOMAIN-CONTAINING
PROTEIN

(Colletotrichum
graminicola) 		PF01344
(Kelch_1)
PF09118
(DUF1929) 		5 TRP A 292
HIS A 362
ASP A 364
GLN A 366
PRO A 312
 None
 1.49A 3b7pA-5c92A:
undetectable		 3b7pA-5c92A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e6s INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		5 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.
5ta1 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 5 TYR A  74
ASP A 416
GLN A 412
GLU A 406
ILE A 408
 None
 1.40A 3b7pA-5ta1A:
undetectable		 3b7pA-5ta1A:
17.51
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.
6blb HOLLIDAY JUNCTION
ATP-DEPENDENT DNA
HELICASE RUVB

(Pseudomonas
aeruginosa) 		no annotation 5 TYR A 311
HIS A 328
ASP A 258
GLN A 309
PRO A 304
 None
 1.22A 3b7pA-6blbA:
2.1		 3b7pA-6blbA:
18.51
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 GLN A  75
TYR A  84
HIS A  85
ASP A 178
GLN A 214
 TER  A 402 ( 4.9A)
TER  A 402 (-4.6A)
None
TER  A 402 (-4.1A)
TER  A 402 ( 3.7A)
 0.82A 3b7pA-6bq6A:
35.6		 3b7pA-6bq6A:
18.42
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 GLN A  75
TYR A  84
HIS A  85
ASP A 178
TYR A 251
 TER  A 402 ( 4.9A)
TER  A 402 (-4.6A)
None
TER  A 402 (-4.1A)
TER  A 402 (-3.4A)
 0.58A 3b7pA-6bq6A:
35.6		 3b7pA-6bq6A:
18.42
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 GLN A 214
HIS A  85
ASP A 178
TYR A 251
ILE A 248
 TER  A 402 ( 3.7A)
None
TER  A 402 (-4.1A)
TER  A 402 (-3.4A)
None
 1.29A 3b7pA-6bq6A:
35.6		 3b7pA-6bq6A:
18.42
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 TYR A  84
HIS A  85
ASP A 178
ASP A 181
GLN A 214
 TER  A 402 (-4.6A)
None
TER  A 402 (-4.1A)
None
TER  A 402 ( 3.7A)
 0.87A 3b7pA-6bq6A:
35.6		 3b7pA-6bq6A:
18.42
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.
6bq6 THERMOSPERMINE
SYNTHASE

(Medicago
truncatula) 		no annotation 5 TYR A  84
HIS A  85
ASP A 178
ASP A 181
TYR A 251
 TER  A 402 (-4.6A)
None
TER  A 402 (-4.1A)
None
TER  A 402 (-3.4A)
 0.97A 3b7pA-6bq6A:
35.6		 3b7pA-6bq6A:
18.42