SIMILAR PATTERNS OF AMINO ACIDS FOR 6B94_B_W9TB201_0

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.
1c1f PROTEIN (CONGERIN I)

(Conger
myriaster) 		PF00337
(Gal-bind_lectin) 		7 HIS A  44
ARG A  48
ASP A  54
ASN A  61
TRP A  70
GLU A  73
ARG A  75
 None
 0.45A 6b94A-1c1fA:
21.6
6b94B-1c1fA:
21.5		 6b94A-1c1fA:
26.83
6b94B-1c1fA:
26.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gan GALECTIN-1

(Rhinella
arenarum) 		PF00337
(Gal-bind_lectin) 		9 HIS A  45
ASN A  47
ARG A  49
HIS A  53
ASP A  55
ASN A  62
TRP A  69
GLU A  72
ARG A  74
 GAL  A 136 (-4.0A)
GAL  A 136 (-3.8A)
NDG  A 135 ( 2.8A)
GAL  A 136 (-3.7A)
None
GAL  A 136 (-3.7A)
GAL  A 136 (-3.7A)
NDG  A 135 ( 2.6A)
NDG  A 135 (-3.4A)
 0.67A 6b94A-1ganA:
24.6
6b94B-1ganA:
24.4		 6b94A-1ganA:
60.49
6b94B-1ganA:
60.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hlc HUMAN LECTIN

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A  45
ASN A  47
ARG A  49
ASN A  58
TRP A  65
GLU A  68
ARG A  70
 GAL  A 998 (-3.8A)
GAL  A 998 (-4.1A)
BGC  A 999 ( 2.7A)
GAL  A 998 (-3.6A)
GAL  A 998 (-3.7A)
BGC  A 999 ( 2.8A)
BGC  A 999 (-4.3A)
 0.50A 6b94A-1hlcA:
23.4
6b94B-1hlcA:
23.2		 6b94A-1hlcA:
30.71
6b94B-1hlcA:
30.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qmj BETA-GALACTOSIDE-BIN
DING LECTIN

(Gallus gallus) 		PF00337
(Gal-bind_lectin) 		9 HIS A  44
ASN A  46
ARG A  48
HIS A  52
ASP A  54
ASN A  61
TRP A  68
GLU A  71
ARG A  73
 None
 0.43A 6b94A-1qmjA:
25.6
6b94B-1qmjA:
25.7		 6b94A-1qmjA:
58.75
6b94B-1qmjA:
58.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1slc BOVINE GALECTIN-1

(Bos taurus) 		PF00337
(Gal-bind_lectin) 		8 HIS A  44
ASN A  46
ARG A  48
HIS A  52
ASN A  61
TRP A  68
GLU A  71
ARG A  73
 GAL  A 352 ( 3.8A)
GAL  A 352 ( 4.2A)
NAG  A 351 ( 3.1A)
GAL  A 352 (-3.5A)
GAL  A 352 ( 3.8A)
GAL  A 352 (-4.3A)
NAG  A 351 ( 2.8A)
NAG  A 351 ( 3.0A)
 0.78A 6b94A-1slcA:
27.4
6b94B-1slcA:
26.5		 6b94A-1slcA:
90.00
6b94B-1slcA:
90.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1slc BOVINE GALECTIN-1

(Bos taurus) 		PF00337
(Gal-bind_lectin) 		8 HIS A  44
ASN A  46
ARG A  48
HIS A  52
ASP A  54
ASN A  61
TRP A  68
GLU A  71
 GAL  A 352 ( 3.8A)
GAL  A 352 ( 4.2A)
NAG  A 351 ( 3.1A)
GAL  A 352 (-3.5A)
NAG  A 355 (-3.4A)
GAL  A 352 ( 3.8A)
GAL  A 352 (-4.3A)
NAG  A 351 ( 2.8A)
 0.47A 6b94A-1slcA:
27.4
6b94B-1slcA:
26.5		 6b94A-1slcA:
90.00
6b94B-1slcA:
90.00
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.
1ule GALECTIN-2

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		6 HIS A  51
ARG A  55
ASN A  64
TRP A  72
GLU A  75
ARG A  77
 GAL  A 152 (-3.8A)
NAG  A 153 ( 2.8A)
GAL  A 152 (-3.9A)
GAL  A 152 (-3.8A)
NAG  A 153 ( 2.8A)
NAG  A 153 (-3.5A)
 0.45A 6b94A-1uleA:
16.1
6b94B-1uleA:
15.2		 6b94A-1uleA:
27.62
6b94B-1uleA:
27.62
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.
1wlc CONGERIN II

(Conger
myriaster) 		PF00337
(Gal-bind_lectin) 		7 HIS A  44
ARG A  48
ASP A  54
ASN A  61
TRP A  69
GLU A  72
ARG A  74
 MES  A 777 ( 4.6A)
None
None
None
None
None
None
 0.63A 6b94A-1wlcA:
24.0
6b94B-1wlcA:
23.5		 6b94A-1wlcA:
29.89
6b94B-1wlcA:
29.89
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.
1ww6 GALECTIN

(Agrocybe
cylindracea) 		PF00337
(Gal-bind_lectin) 		6 HIS A  62
ARG A  66
ASN A  75
TRP A  83
GLU A  86
ARG A  88
 GAL  A 200 (-4.1A)
BGC  A 201 ( 3.0A)
GAL  A 200 (-3.7A)
GAL  A 200 (-3.6A)
BGC  A 201 ( 3.1A)
BGC  A 201 ( 4.3A)
 0.73A 6b94A-1ww6A:
14.6
6b94B-1ww6A:
14.2		 6b94A-1ww6A:
20.25
6b94B-1ww6A:
20.25
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.
2d3t 3-KETOACYL-COA
THIOLASE

(Pseudomonas
fragi) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 HIS C 339
ASP C 211
ASN C 362
GLU C 192
ARG C  15
 None
 1.37A 6b94A-2d3tC:
undetectable
6b94B-2d3tC:
undetectable		 6b94A-2d3tC:
12.19
6b94B-2d3tC:
12.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2d6l LECTIN, GALACTOSE
BINDING, SOLUBLE 9

(Mus musculus) 		PF00337
(Gal-bind_lectin) 		7 HIS X  60
ASN X  62
ARG X  64
ASN X  74
TRP X  81
GLU X  84
ARG X  86
 None
 0.54A 6b94A-2d6lX:
19.2
6b94B-2d6lX:
18.8		 6b94A-2d6lX:
33.67
6b94B-2d6lX:
33.67
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.
2dyc GALECTIN-4

(Mus musculus) 		PF00337
(Gal-bind_lectin) 		6 HIS A  63
ASN A  65
ARG A  67
ASN A  77
TRP A  84
GLU A  87
 None
 0.60A 6b94A-2dycA:
18.9
6b94B-2dycA:
18.5		 6b94A-2dycA:
26.12
6b94B-2dycA:
26.12
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.
2r0h CGL3 LECTIN

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		5 HIS A  60
ARG A  64
ASN A  73
GLU A  84
ARG A  86
 CTO  A 165 (-3.6A)
CTO  A 165 (-2.6A)
CTO  A 165 (-4.1A)
CTO  A 165 (-2.7A)
CTO  A 165 ( 4.0A)
 0.39A 6b94A-2r0hA:
14.4
6b94B-2r0hA:
13.8		 6b94A-2r0hA:
18.54
6b94B-2r0hA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		7 HIS A 435
ASN A 437
ARG A 439
ASN A 451
TRP A 459
GLU A 462
ARG A 464
 None
 0.57A 6b94A-2wsuA:
18.5
6b94B-2wsuA:
17.9		 6b94A-2wsuA:
13.76
6b94B-2wsuA:
13.76
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.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		5 HIS A 593
ASN A 595
ASN A 609
TRP A 616
GLU A 619
 GOL  A1686 (-4.0A)
None
GOL  A1686 (-3.7A)
GOL  A1686 (-3.7A)
GOL  A1686 (-4.2A)
 0.78A 6b94A-2wsuA:
18.5
6b94B-2wsuA:
17.9		 6b94A-2wsuA:
13.76
6b94B-2wsuA:
13.76
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.
2ymz GALECTIN 2

(Gallus gallus) 		PF00337
(Gal-bind_lectin) 		5 HIS A  45
ASN A  47
ASN A  58
TRP A  65
ARG A  70
 None
 0.36A 6b94A-2ymzA:
24.1
6b94B-2ymzA:
23.9		 6b94A-2ymzA:
28.35
6b94B-2ymzA:
28.35
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.
2zgk ANTI-TUMOR LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		6 HIS A  59
ARG A  63
ASN A  72
TRP A  80
GLU A  83
ARG A  85
 None
 0.77A 6b94A-2zgkA:
15.0
6b94B-2zgkA:
14.4		 6b94A-2zgkA:
19.75
6b94B-2zgkA:
19.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zhl GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A  61
ASN A  63
ARG A  65
ASN A  75
TRP A  82
GLU A  85
ARG A  87
 GAL  A1493 ( 3.9A)
GAL  A1493 (-3.6A)
NAG  A1494 ( 2.8A)
GAL  A1493 (-3.9A)
GAL  A1493 (-3.7A)
NAG  A1494 ( 2.7A)
NAG  A1494 (-4.0A)
 0.43A 6b94A-2zhlA:
19.9
6b94B-2zhlA:
19.7		 6b94A-2zhlA:
32.29
6b94B-2zhlA:
32.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ajy ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		7 HIS A  44
ARG A  48
ASP A  54
ASN A  61
TRP A  68
GLU A  71
ARG A  73
 GAL  A 136 (-3.9A)
BGC  A 135 ( 2.9A)
None
GAL  A 136 (-3.7A)
GAL  A 136 (-3.5A)
BGC  A 135 ( 2.6A)
BGC  A 135 (-4.1A)
 0.81A 6b94A-3ajyA:
22.0
6b94B-3ajyA:
21.9		 6b94A-3ajyA:
43.21
6b94B-3ajyA:
43.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ajz ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		7 HIS A  42
ARG A  46
ASP A  52
ASN A  59
TRP A  66
GLU A  69
ARG A  71
 GAL  A 133 (-4.0A)
BGC  A 134 ( 2.8A)
None
GAL  A 133 (-3.8A)
GAL  A 133 (-3.7A)
BGC  A 134 ( 2.8A)
BGC  A 134 ( 4.4A)
 0.74A 6b94A-3ajzA:
24.5
6b94B-3ajzA:
24.4		 6b94A-3ajzA:
35.63
6b94B-3ajzA:
35.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ayd GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
ARG A 186
 GAL  A 253 (-3.7A)
GAL  A 253 (-4.1A)
A2G  A 252 ( 3.1A)
GAL  A 253 (-3.9A)
GAL  A 253 (-3.5A)
A2G  A 252 (-3.0A)
GAL  A 256 ( 3.8A)
 0.41A 6b94A-3aydA:
19.4
6b94B-3aydA:
19.1		 6b94A-3aydA:
34.78
6b94B-3aydA:
34.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dui BETA-GALACTOSIDE-BIN
DING LECTIN

(Gallus gallus) 		PF00337
(Gal-bind_lectin) 		9 HIS A  45
ASN A  47
ARG A  49
HIS A  53
ASP A  55
ASN A  62
TRP A  69
GLU A  72
ARG A  74
 None
 0.70A 6b94A-3duiA:
24.3
6b94B-3duiA:
24.6		 6b94A-3duiA:
68.29
6b94B-3duiA:
68.29
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.
3goa 3-KETOACYL-COA
THIOLASE

(Salmonella
enterica) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ASN A 335
ASP A 207
ASN A 358
GLU A 188
ARG A  11
 None
None
CL  A 388 (-3.2A)
None
None
 1.38A 6b94A-3goaA:
undetectable
6b94B-3goaA:
undetectable		 6b94A-3goaA:
10.25
6b94B-3goaA:
10.25
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.
3i8t GALECTIN-4

(Mus musculus) 		PF00337
(Gal-bind_lectin) 		6 HIS A  75
ASN A  77
ARG A  79
ASN A  89
TRP A  96
GLU A  99
 LBT  A 165 (-4.0A)
GOL  A 167 ( 3.2A)
LBT  A 165 (-2.6A)
LBT  A 165 (-3.8A)
LBT  A 165 ( 3.6A)
LBT  A 165 (-3.0A)
 0.37A 6b94A-3i8tA:
19.4
6b94B-3i8tA:
19.0		 6b94A-3i8tA:
24.49
6b94B-3i8tA:
24.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3m2m GALECTIN-1

(Rattus
norvegicus) 		PF00337
(Gal-bind_lectin) 		9 HIS A  44
ASN A  46
ARG A  48
HIS A  52
ASP A  54
ASN A  61
TRP A  68
GLU A  71
ARG A  73
 LAT  A 999 (-3.7A)
LAT  A 999 (-4.1A)
LAT  A 999 (-3.1A)
LAT  A 999 (-3.9A)
None
LAT  A 999 (-3.7A)
LAT  A 999 (-3.7A)
LAT  A 999 (-3.0A)
LAT  A 999 ( 4.7A)
 0.38A 6b94A-3m2mA:
26.7
6b94B-3m2mA:
25.9		 6b94A-3m2mA:
92.50
6b94B-3m2mA:
92.50
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.
3n0g ISOPRENE SYNTHASE

(Populus tremula
x Populus alba) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 HIS A 237
ARG A 116
ASP A 112
GLU A 196
ARG A 156
 None
 1.47A 6b94A-3n0gA:
undetectable
6b94B-3n0gA:
undetectable		 6b94A-3n0gA:
9.20
6b94B-3n0gA:
9.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nv3 GALECTIN 9 SHORT
ISOFORM VARIANT

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 235
ASN A 237
ARG A 239
ASN A 248
TRP A 255
GLU A 258
ARG A 260
 GAL  A 501 (-3.9A)
GAL  A 501 (-3.8A)
NAG  A 502 ( 2.7A)
GAL  A 501 (-3.8A)
GAL  A 501 (-3.6A)
NAG  A 502 ( 2.7A)
NAG  A 502 (-4.0A)
 0.39A 6b94A-3nv3A:
19.4
6b94B-3nv3A:
18.6		 6b94A-3nv3A:
23.31
6b94B-3nv3A:
23.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ojb GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		5 HIS A  53
ASN A  55
ASN A  66
TRP A  73
ARG A  78
 None
 0.47A 6b94A-3ojbA:
19.7
6b94B-3ojbA:
19.0		 6b94A-3ojbA:
36.67
6b94B-3ojbA:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vv1 PROTEIN LEC-6

(Caenorhabditis
elegans) 		PF00337
(Gal-bind_lectin) 		7 HIS A  60
ASN A  62
ARG A  64
ASN A  73
TRP A  80
GLU A  83
ARG A  85
 GAL  A 201 (-3.8A)
GAL  A 201 (-3.9A)
FUC  A 202 (-2.7A)
GAL  A 201 (-3.8A)
GAL  A 201 ( 3.8A)
FUC  A 202 (-2.7A)
FUC  A 202 ( 4.1A)
 0.41A 6b94A-3vv1A:
18.2
6b94B-3vv1A:
18.1		 6b94A-3vv1A:
31.00
6b94B-3vv1A:
31.00
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.
3wg1 GALACTOSIDE-BINDING
LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		6 HIS A  62
ARG A  66
ASN A  75
TRP A  83
GLU A  86
ARG A  88
 LAT  A 201 (-3.9A)
LAT  A 201 (-3.0A)
LAT  A 201 (-4.1A)
LAT  A 201 (-3.8A)
LAT  A 201 (-2.8A)
LAT  A 201 (-4.4A)
 0.62A 6b94A-3wg1A:
14.8
6b94B-3wg1A:
14.2		 6b94A-3wg1A:
20.12
6b94B-3wg1A:
20.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wuc GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		7 HIS A  47
ASN A  49
ARG A  51
ASP A  57
ASN A  64
TRP A  71
GLU A  74
 GAL  A 202 ( 3.9A)
GAL  A 202 (-4.0A)
GLC  A 201 (-2.7A)
None
GAL  A 202 (-3.9A)
GAL  A 202 ( 3.7A)
GLC  A 201 (-2.8A)
 0.42A 6b94A-3wucA:
23.9
6b94B-3wucA:
23.9		 6b94A-3wucA:
42.35
6b94B-3wucA:
42.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wud GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		9 HIS A  45
ASN A  47
ARG A  49
HIS A  52
ASP A  55
ASN A  62
TRP A  69
GLU A  72
ARG A  74
 GAL  A 202 (-3.8A)
GAL  A 202 (-4.0A)
GLC  A 201 (-2.7A)
SO4  A 203 (-3.9A)
None
GAL  A 202 (-3.9A)
GAL  A 202 (-3.9A)
GLC  A 201 (-2.7A)
GLC  A 201 (-4.0A)
 1.00A 6b94A-3wudA:
25.3
6b94B-3wudA:
24.9		 6b94A-3wudA:
60.00
6b94B-3wudA:
60.00
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.
3wv6 GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A  61
ASN A  63
ARG A  65
ASN A  75
TRP A  82
GLU A  85
ARG A  87
 GAL  A 402 (-3.9A)
GAL  A 402 (-3.9A)
BGC  A 403 (-2.7A)
GAL  A 402 (-4.0A)
GAL  A 402 (-3.7A)
BGC  A 403 (-2.9A)
BGC  A 403 (-4.1A)
 0.46A 6b94A-3wv6A:
19.4
6b94B-3wv6A:
19.1		 6b94A-3wv6A:
12.93
6b94B-3wv6A:
12.93
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.
3wv6 GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 235
ASN A 237
ARG A 239
ASN A 248
TRP A 255
GLU A 258
ARG A 260
 GAL  A 404 (-4.0A)
GAL  A 404 (-4.1A)
GLC  A 405 (-2.7A)
GAL  A 404 (-3.7A)
GAL  A 404 ( 3.7A)
GLC  A 405 ( 2.8A)
GLC  A 405 (-4.3A)
 0.44A 6b94A-3wv6A:
19.4
6b94B-3wv6A:
19.1		 6b94A-3wv6A:
12.93
6b94B-3wv6A:
12.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zxe GALECTIN-7

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A  49
ASN A  51
ARG A  53
ASN A  62
TRP A  69
GLU A  72
ARG A  74
 PGZ  A   1 (-3.9A)
PGZ  A   1 (-3.8A)
PGZ  A   1 (-3.6A)
PGZ  A   1 (-3.8A)
PGZ  A   1 (-4.0A)
PGZ  A   1 (-3.5A)
None
 0.63A 6b94A-3zxeA:
20.2
6b94B-3zxeA:
19.5		 6b94A-3zxeA:
38.37
6b94B-3zxeA:
38.37
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.
4agv GALECTIN

(Cinachyrella) 		PF00337
(Gal-bind_lectin) 		5 ARG A  47
ASN A  60
TRP A  68
GLU A  71
ARG A  73
 None
 0.51A 6b94A-4agvA:
16.9
6b94B-4agvA:
16.2		 6b94A-4agvA:
23.44
6b94B-4agvA:
23.44
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.
4bmb GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  65
ASN A  67
ARG A  69
ASN A  79
TRP A  86
GLU A  89
 LAT  A1155 (-3.9A)
LAT  A1155 (-3.9A)
LAT  A1155 (-2.7A)
LAT  A1155 (-3.9A)
LAT  A1155 (-3.6A)
LAT  A1155 (-3.0A)
 0.41A 6b94A-4bmbA:
18.9
6b94B-4bmbA:
18.6		 6b94A-4bmbA:
29.57
6b94B-4bmbA:
29.57
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.
4fqz GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		5 HIS A  65
ASN A  67
ARG A  45
ASN A  79
TRP A  86
 GAL  A 401 (-4.0A)
GAL  A 401 (-4.2A)
GAL  A 401 (-2.8A)
GAL  A 401 (-3.8A)
GAL  A 401 (-3.5A)
 1.33A 6b94A-4fqzA:
18.2
6b94B-4fqzA:
17.8		 6b94A-4fqzA:
16.25
6b94B-4fqzA:
16.25
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.
4fqz GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  65
ASN A  67
ARG A  69
ASN A  79
TRP A  86
GLU A  89
 GAL  A 401 (-4.0A)
GAL  A 401 (-4.2A)
BGC  A 402 ( 2.5A)
GAL  A 401 (-3.8A)
GAL  A 401 (-3.5A)
BGC  A 402 ( 3.3A)
 0.42A 6b94A-4fqzA:
18.2
6b94B-4fqzA:
17.8		 6b94A-4fqzA:
16.25
6b94B-4fqzA:
16.25
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.
4fqz GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 229
ASN A 231
ARG A 233
ASN A 242
TRP A 249
GLU A 252
ARG A 254
 None
 0.48A 6b94A-4fqzA:
18.2
6b94B-4fqzA:
17.8		 6b94A-4fqzA:
16.25
6b94B-4fqzA:
16.25
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.
4hl0 GALECTIN

(Toxascaris
leonina) 		PF00337
(Gal-bind_lectin) 		5 HIS A  57
ASN A  70
TRP A  77
GLU A  80
ARG A  82
 None
 0.88A 6b94A-4hl0A:
20.5
6b94B-4hl0A:
20.0		 6b94A-4hl0A:
18.03
6b94B-4hl0A:
18.03
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.
4hl0 GALECTIN

(Toxascaris
leonina) 		PF00337
(Gal-bind_lectin) 		6 HIS A 192
ASN A 194
ARG A 196
ASN A 205
TRP A 212
GLU A 215
 None
 0.29A 6b94A-4hl0A:
20.5
6b94B-4hl0A:
20.0		 6b94A-4hl0A:
18.03
6b94B-4hl0A:
18.03
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.
4il1 CALMODULIN,
CALCINEURIN SUBUNIT
B TYPE 1,
SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2B
CATALYTIC SUBUNIT
ALPHA ISOFORM

(Rattus
norvegicus) 		PF00149
(Metallophos)
PF13499
(EF-hand_7) 		5 HIS A 532
ASN A 483
HIS A 425
ASP A 454
GLU A 485
 None
 1.35A 6b94A-4il1A:
undetectable
6b94B-4il1A:
undetectable		 6b94A-4il1A:
7.67
6b94B-4il1A:
7.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wvw GALECTIN

(Gallus gallus) 		PF00337
(Gal-bind_lectin) 		6 HIS A  64
ASN A  66
ARG A  68
ASN A  78
TRP A  85
GLU A  88
 SLT  A 201 (-3.9A)
SLT  A 201 (-3.8A)
SLT  A 201 (-2.7A)
SLT  A 201 (-3.9A)
SLT  A 201 (-3.6A)
SLT  A 201 (-2.8A)
 0.34A 6b94A-4wvwA:
19.3
6b94B-4wvwA:
18.9		 6b94A-4wvwA:
32.61
6b94B-4wvwA:
32.61
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.
4xzp GALECTIN-4

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  63
ASN A  65
ARG A  67
ASN A  77
TRP A  84
GLU A  87
 None
 0.54A 6b94A-4xzpA:
17.5
6b94B-4xzpA:
17.2		 6b94A-4xzpA:
24.52
6b94B-4xzpA:
24.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4y1y GALECTIN-1

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		9 HIS A  44
ASN A  46
ARG A  48
HIS A  52
ASP A  54
ASN A  61
TRP A  68
GLU A  71
ARG A  73
 GAL  A 201 (-3.9A)
GAL  A 201 (-4.4A)
6S2  A 202 (-2.8A)
GAL  A 201 (-4.2A)
6S2  A 202 (-3.5A)
GAL  A 201 (-3.8A)
GAL  A 201 ( 4.1A)
6S2  A 202 (-2.6A)
6S2  A 202 (-3.8A)
 0.44A 6b94A-4y1yA:
28.7
6b94B-4y1yA:
26.8		 6b94A-4y1yA:
78.79
6b94B-4y1yA:
78.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4y26 GALECTIN-7

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A  49
ASN A  51
ARG A  53
ASN A  62
TRP A  69
GLU A  72
ARG A  74
 GAL  A 201 (-3.9A)
GAL  A 201 (-4.1A)
6S2  A 202 (-2.9A)
GAL  A 201 (-3.7A)
GAL  A 201 (-3.5A)
6S2  A 202 (-2.8A)
6S2  A 202 (-3.5A)
 0.71A 6b94A-4y26A:
20.0
6b94B-4y26A:
19.4		 6b94A-4y26A:
35.51
6b94B-4y26A:
35.51
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.
4ym3 GALECTIN-4

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A 236
ASN A 238
ARG A 240
ASN A 249
TRP A 256
GLU A 259
 LAT  A 401 (-3.9A)
LAT  A 401 (-4.0A)
LAT  A 401 (-2.6A)
LAT  A 401 (-3.7A)
LAT  A 401 ( 3.8A)
LAT  A 401 (-3.1A)
 0.35A 6b94A-4ym3A:
18.7
6b94B-4ym3A:
18.2		 6b94A-4ym3A:
24.46
6b94B-4ym3A:
24.46
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.
5b47 2-OXOACID--FERREDOXI
N OXIDOREDUCTASE
ALPHA SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01558
(POR)
PF01855
(POR_N)
PF17147
(PFOR_II) 		5 THR A 353
HIS A  48
ASN A  37
GLU A  39
ARG A 600
 None
 1.39A 6b94A-5b47A:
undetectable
6b94B-5b47A:
undetectable		 6b94A-5b47A:
8.56
6b94B-5b47A:
8.56
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.
5dux GALECTIN-4

(Homo sapiens) 		no annotation 6 HIS B  63
ASN B  65
ARG B  67
ASN B  77
TRP B  84
GLU B  87
 LAT  B 201 (-3.9A)
LAT  B 201 (-3.8A)
LAT  B 201 (-2.6A)
LAT  B 201 (-3.9A)
LAT  B 201 ( 3.8A)
LAT  B 201 (-2.4A)
 0.33A 6b94A-5duxB:
19.4
6b94B-5duxB:
19.1		 6b94A-5duxB:
27.69
6b94B-5duxB:
27.69
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.
5gzg GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  65
ASN A  67
ARG A  69
ASN A  79
TRP A  86
GLU A  89
 LAT  A 201 (-3.9A)
LAT  A 201 (-4.2A)
LAT  A 201 (-2.3A)
LAT  A 201 (-3.6A)
LAT  A 201 (-3.7A)
LAT  A 201 (-3.0A)
 0.40A 6b94A-5gzgA:
18.7
6b94B-5gzgA:
18.4		 6b94A-5gzgA:
23.17
6b94B-5gzgA:
23.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5h9p GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
ARG A 186
 TD2  A 301 (-3.8A)
TD2  A 301 (-4.0A)
TD2  A 301 (-2.8A)
TD2  A 301 (-3.8A)
TD2  A 301 ( 3.7A)
TD2  A 301 (-2.9A)
TD2  A 301 (-3.9A)
 0.38A 6b94A-5h9pA:
19.8
6b94B-5h9pA:
19.3		 6b94A-5h9pA:
32.43
6b94B-5h9pA:
32.43
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.
5jp5 GALECTIN-5

(Rattus
norvegicus) 		PF00337
(Gal-bind_lectin) 		7 HIS A  57
ASN A  59
ARG A  61
ASN A  70
TRP A  77
GLU A  80
ARG A  82
 PEG  A 201 (-3.7A)
PEG  A 201 ( 4.8A)
PEG  A 201 (-3.0A)
PEG  A 201 (-3.6A)
PEG  A 201 (-2.8A)
PEG  A 201 (-3.3A)
None
 0.45A 6b94A-5jp5A:
19.3
6b94B-5jp5A:
18.7		 6b94A-5jp5A:
25.56
6b94B-5jp5A:
25.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5nfb GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		7 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
ARG A 186
 8VT  A 301 (-3.9A)
8VT  A 301 (-4.0A)
8VT  A 301 (-2.7A)
8VT  A 301 (-3.8A)
8VT  A 301 ( 3.7A)
8VT  A 301 (-2.7A)
8VT  A 301 (-3.4A)
 0.34A 6b94A-5nfbA:
19.8
6b94B-5nfbA:
19.4		 6b94A-5nfbA:
37.63
6b94B-5nfbA:
37.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5nlh GALECTIN

(Gallus gallus) 		no annotation 6 HIS A  48
ASN A  50
ARG A  52
ASN A  61
TRP A  68
GLU A  71
 LBT  A 201 (-3.5A)
LBT  A 201 (-3.7A)
LBT  A 201 (-2.6A)
LBT  A 201 (-3.9A)
LBT  A 201 (-3.0A)
LBT  A 201 (-2.1A)
 0.32A 6b94A-5nlhA:
19.3
6b94B-5nlhA:
18.6		 6b94A-5nlhA:
32.93
6b94B-5nlhA:
32.93
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.
6byi BETA-MANNOSIDASE

(Xanthomonas
citri) 		no annotation 5 THR A 480
ASN A 376
ARG A 408
ASP A 434
TRP A 552
 None
None
None
None
BMA  A 901 (-3.7A)
 1.48A 6b94A-6byiA:
undetectable
6b94B-6byiA:
undetectable		 6b94A-6byiA:
undetectable
6b94B-6byiA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fof GALECTIN-3,GALECTIN-
3

(Homo sapiens) 		no annotation 7 HIS C 158
ASN C 160
ARG C 162
ASN C 174
TRP C 181
GLU C 184
ARG C 186
 LAT  C 301 (-3.8A)
LAT  C 301 (-4.1A)
LAT  C 301 (-2.7A)
LAT  C 301 (-3.8A)
LAT  C 301 (-3.8A)
LAT  C 301 ( 2.8A)
LAT  C 301 (-4.0A)
 0.45A 6b94A-6fofC:
19.2
6b94B-6fofC:
18.5		 6b94A-6fofC:
undetectable
6b94B-6fofC:
undetectable