SIMILAR PATTERNS OF AMINO ACIDS FOR 3GAL_A_1GNA998_1

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.
1bjn PHOSPHOSERINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00266
(Aminotran_5) 		4 ASN A 294
ARG A 293
TRP A 137
GLU A 161
 None
 1.42A 3galA-1bjnA:
undetectable		 3galA-1bjnA:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c1f PROTEIN (CONGERIN I)

(Conger
myriaster) 		PF00337
(Gal-bind_lectin) 		5 HIS A  44
ARG A  48
ASN A  61
TRP A  70
GLU A  73
 None
 0.23A 3galA-1c1fA:
17.1		 3galA-1c1fA:
27.40
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.
1feh PROTEIN (PERIPLASMIC
HYDROGENASE 1)

(Clostridium
pasteurianum) 		PF02256
(Fe_hyd_SSU)
PF02906
(Fe_hyd_lg_C)
PF12838
(Fer4_7)
PF13510
(Fer2_4) 		4 ASN A 106
ARG A 103
ASN A 513
GLU A 108
 None
 1.50A 3galA-1fehA:
undetectable		 3galA-1fehA:
12.81
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) 		6 HIS A  45
ASN A  47
ARG A  49
ASN A  62
TRP A  69
GLU A  72
 GAL  A 136 (-4.0A)
GAL  A 136 (-3.8A)
NDG  A 135 ( 2.8A)
GAL  A 136 (-3.7A)
GAL  A 136 (-3.7A)
NDG  A 135 ( 2.6A)
 0.20A 3galA-1ganA:
19.8		 3galA-1ganA:
33.33
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.
1gpl RP2 LIPASE

(Cavia porcellus) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 ASN A 100
ARG A  68
ASN A  63
GLU A  44
 None
 1.22A 3galA-1gplA:
undetectable		 3galA-1gplA:
15.80
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.
1hlc HUMAN LECTIN

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  45
ASN A  47
ARG A  49
ASN A  58
TRP A  65
GLU A  68
 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)
 0.44A 3galA-1hlcA:
20.0		 3galA-1hlcA:
28.57
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.
1hpl LIPASE

(Equus caballus) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 ASN A 100
ARG A  68
ASN A  63
GLU A  44
 None
 1.10A 3galA-1hplA:
undetectable		 3galA-1hplA:
16.20
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.
1j31 HYPOTHETICAL PROTEIN
PH0642

(Pyrococcus
horikoshii) 		PF00795
(CN_hydrolase) 		4 ASN A 171
ARG A 197
ASN A  49
GLU A 201
 None
 1.37A 3galA-1j31A:
undetectable		 3galA-1j31A:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lpb LIPASE

(Homo sapiens) 		PF00151
(Lipase)
PF01477
(PLAT) 		4 ASN B 100
ARG B  68
ASN B  63
GLU B  44
 None
 1.06A 3galA-1lpbB:
undetectable		 3galA-1lpbB:
15.19
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) 		6 HIS A  44
ASN A  46
ARG A  48
ASN A  61
TRP A  68
GLU A  71
 None
 0.27A 3galA-1qmjA:
19.8		 3galA-1qmjA:
30.22
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) 		6 HIS A  44
ASN A  46
ARG A  48
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 ( 3.8A)
GAL  A 352 (-4.3A)
NAG  A 351 ( 2.8A)
 0.43A 3galA-1slcA:
19.9		 3galA-1slcA:
33.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ule GALECTIN-2

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		5 HIS A  51
ARG A  55
ASN A  64
TRP A  72
GLU A  75
 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)
 0.30A 3galA-1uleA:
16.9		 3galA-1uleA:
24.18
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.
1vlp NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Saccharomyces
cerevisiae) 		PF04095
(NAPRTase) 		4 HIS A 387
ARG A 407
ASN A 386
GLU A 243
 None
 1.48A 3galA-1vlpA:
undetectable		 3galA-1vlpA:
15.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wlc CONGERIN II

(Conger
myriaster) 		PF00337
(Gal-bind_lectin) 		5 HIS A  44
ARG A  48
ASN A  61
TRP A  69
GLU A  72
 MES  A 777 ( 4.6A)
None
None
None
None
 0.20A 3galA-1wlcA:
19.5		 3galA-1wlcA:
29.66
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.
1ww6 GALECTIN

(Agrocybe
cylindracea) 		PF00337
(Gal-bind_lectin) 		5 HIS A  62
ARG A  66
ASN A  75
TRP A  83
GLU A  86
 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)
 0.58A 3galA-1ww6A:
16.0		 3galA-1ww6A:
23.57
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.
2btw ALR0975 PROTEIN

(Nostoc sp. PCC
7120) 		PF05023
(Phytochelatin) 		4 ARG A 153
ASN A 148
TRP A 218
GLU A 150
 None
 1.46A 3galA-2btwA:
undetectable		 3galA-2btwA:
18.95
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) 		6 HIS X  60
ASN X  62
ARG X  64
ASN X  74
TRP X  81
GLU X  84
 None
 0.31A 3galA-2d6lX:
22.4		 3galA-2d6lX:
33.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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
 0.50A 3galA-2dycA:
23.6		 3galA-2dycA:
35.81
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.
2gwn DIHYDROOROTASE

(Porphyromonas
gingivalis) 		PF01979
(Amidohydro_1) 		4 HIS A 181
ASN A 286
ARG A 212
GLU A 185
 ZN  A 601 ( 3.2A)
CAC  A 603 ( 4.7A)
None
None
 1.39A 3galA-2gwnA:
undetectable		 3galA-2gwnA:
14.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i00 ACETYLTRANSFERASE,
GNAT FAMILY

(Enterococcus
faecalis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		4 HIS A  85
ASN A 368
ARG A 371
GLU A 312
 None
 1.34A 3galA-2i00A:
undetectable		 3galA-2i00A:
16.80
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) 		4 HIS A  60
ARG A  64
ASN A  73
GLU A  84
 CTO  A 165 (-3.6A)
CTO  A 165 (-2.6A)
CTO  A 165 (-4.1A)
CTO  A 165 (-2.7A)
 0.45A 3galA-2r0hA:
15.8		 3galA-2r0hA:
26.25
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.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		6 HIS A 435
ASN A 437
ARG A 439
ASN A 451
TRP A 459
GLU A 462
 None
 0.59A 3galA-2wsuA:
19.7		 3galA-2wsuA:
19.19
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.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		4 HIS A 593
ASN A 595
ASN A 609
TRP A 616
 GOL  A1686 (-4.0A)
None
GOL  A1686 (-3.7A)
GOL  A1686 (-3.7A)
 0.54A 3galA-2wsuA:
19.7		 3galA-2wsuA:
19.19
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.
2wsu PUTATIVE FIBER
PROTEIN

(Porcine
mastadenovirus
B) 		PF00337
(Gal-bind_lectin) 		4 HIS A 593
ASN A 609
TRP A 616
GLU A 619
 GOL  A1686 (-4.0A)
GOL  A1686 (-3.7A)
GOL  A1686 (-3.7A)
GOL  A1686 (-4.2A)
 0.84A 3galA-2wsuA:
19.7		 3galA-2wsuA:
19.19
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.
2ymz GALECTIN 2

(Gallus gallus) 		PF00337
(Gal-bind_lectin) 		4 HIS A  45
ASN A  47
ASN A  58
TRP A  65
 None
 0.28A 3galA-2ymzA:
20.7		 3galA-2ymzA:
29.37
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.
2yn7 OUTER SURFACE
PROTEIN

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		4 HIS A 295
ASN A 292
ASN A 294
GLU A 291
 None
 1.27A 3galA-2yn7A:
undetectable		 3galA-2yn7A:
18.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yro GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		4 HIS A  61
ASN A  63
ASN A  74
TRP A  81
 None
 0.68A 3galA-2yroA:
19.0		 3galA-2yroA:
37.16
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.
2zgk ANTI-TUMOR LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		4 ASN A  43
ARG A  63
TRP A  80
GLU A  83
 None
 1.13A 3galA-2zgkA:
16.3		 3galA-2zgkA:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zgk ANTI-TUMOR LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		5 HIS A  59
ARG A  63
ASN A  72
TRP A  80
GLU A  83
 None
 0.63A 3galA-2zgkA:
16.3		 3galA-2zgkA:
22.56
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) 		4 HIS A  61
ASN A  63
ARG A  44
TRP A  82
 GAL  A1493 ( 3.9A)
GAL  A1493 (-3.6A)
NAG  A1491 (-4.6A)
GAL  A1493 (-3.7A)
 1.10A 3galA-2zhlA:
23.0		 3galA-2zhlA:
38.16
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) 		6 HIS A  61
ASN A  63
ARG A  65
ASN A  75
TRP A  82
GLU A  85
 GAL  A1493 ( 3.9A)
GAL  A1493 (-3.6A)
NAG  A1494 ( 2.8A)
GAL  A1493 (-3.9A)
GAL  A1493 (-3.7A)
NAG  A1494 ( 2.7A)
 0.32A 3galA-2zhlA:
23.0		 3galA-2zhlA:
38.16
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.
3ajy ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		5 HIS A  44
ARG A  48
ASN A  61
TRP A  68
GLU A  71
 GAL  A 136 (-3.9A)
BGC  A 135 ( 2.9A)
GAL  A 136 (-3.7A)
GAL  A 136 (-3.5A)
BGC  A 135 ( 2.6A)
 0.36A 3galA-3ajyA:
17.4		 3galA-3ajyA:
27.66
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.
3ajz ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		5 HIS A  42
ARG A  46
ASN A  59
TRP A  66
GLU A  69
 GAL  A 133 (-4.0A)
BGC  A 134 ( 2.8A)
GAL  A 133 (-3.8A)
GAL  A 133 (-3.7A)
BGC  A 134 ( 2.8A)
 0.19A 3galA-3ajzA:
19.7		 3galA-3ajzA:
29.29
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) 		6 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
 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)
 0.22A 3galA-3aydA:
22.4		 3galA-3aydA:
35.25
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) 		6 HIS A  45
ASN A  47
ARG A  49
ASN A  62
TRP A  69
GLU A  72
 None
 0.56A 3galA-3duiA:
18.7		 3galA-3duiA:
33.33
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.
3ekm DIAMINOPIMELATE
EPIMERASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01678
(DAP_epimerase) 		4 HIS A 190
ASN A 227
ARG A 246
GLU A  97
 None
ZDR  A 500 (-3.0A)
ZDR  A 500 (-3.7A)
None
 1.40A 3galA-3ekmA:
undetectable		 3galA-3ekmA:
16.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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)
 0.25A 3galA-3i8tA:
24.2		 3galA-3i8tA:
33.33
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.
3ki8 BETA
UREIDOPROPIONASE
(BETA-ALANINE
SYNTHASE)

(Pyrococcus
abyssi) 		PF00795
(CN_hydrolase) 		4 ASN A 171
ARG A 197
ASN A  49
GLU A 201
 None
 1.44A 3galA-3ki8A:
undetectable		 3galA-3ki8A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ksc LEGA CLASS

(Pisum sativum) 		PF00190
(Cupin_1) 		4 HIS A 166
ARG A  60
ASN A 165
GLU A 218
 None
 1.36A 3galA-3kscA:
undetectable		 3galA-3kscA:
13.51
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) 		6 HIS A  44
ASN A  46
ARG A  48
ASN A  61
TRP A  68
GLU A  71
 LAT  A 999 (-3.7A)
LAT  A 999 (-4.1A)
LAT  A 999 (-3.1A)
LAT  A 999 (-3.7A)
LAT  A 999 (-3.7A)
LAT  A 999 (-3.0A)
 0.32A 3galA-3m2mA:
20.1		 3galA-3m2mA:
30.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nv3 GALECTIN 9 SHORT
ISOFORM VARIANT

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A 235
ASN A 237
ARG A 239
ASN A 248
TRP A 255
GLU A 258
 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)
 0.20A 3galA-3nv3A:
22.9		 3galA-3nv3A:
38.89
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.
3oja ANOPHELES
PLASMODIUM-RESPONSIV
E LEUCINE-RICH
REPEAT PROTEIN 1

(Anopheles
gambiae) 		PF13855
(LRR_8) 		4 ASN B 414
ARG B 621
ASN B 391
GLU B 392
 None
 1.40A 3galA-3ojaB:
undetectable		 3galA-3ojaB:
13.60
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) 		4 HIS A  53
ASN A  55
ASN A  66
GLU A  76
 None
 0.82A 3galA-3ojbA:
22.7		 3galA-3ojbA:
35.46
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) 		4 HIS A  53
ASN A  55
ASN A  66
TRP A  73
 None
 0.40A 3galA-3ojbA:
22.7		 3galA-3ojbA:
35.46
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) 		6 HIS A  60
ASN A  62
ARG A  64
ASN A  73
TRP A  80
GLU A  83
 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)
 0.17A 3galA-3vv1A:
21.1		 3galA-3vv1A:
30.91
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.
3wg1 GALACTOSIDE-BINDING
LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		5 HIS A  62
ARG A  66
ASN A  75
TRP A  83
GLU A  86
 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)
 0.37A 3galA-3wg1A:
16.1		 3galA-3wg1A:
23.53
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.
3wuc GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		4 HIS A  47
ASN A  49
ARG A  32
TRP A  71
 GAL  A 202 ( 3.9A)
GAL  A 202 (-4.0A)
GAL  A 202 (-2.8A)
GAL  A 202 ( 3.7A)
 1.18A 3galA-3wucA:
18.7		 3galA-3wucA:
25.33
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.
3wuc GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		6 HIS A  47
ASN A  49
ARG A  51
ASN A  64
TRP A  71
GLU A  74
 GAL  A 202 ( 3.9A)
GAL  A 202 (-4.0A)
GLC  A 201 (-2.7A)
GAL  A 202 (-3.9A)
GAL  A 202 ( 3.7A)
GLC  A 201 (-2.8A)
 0.25A 3galA-3wucA:
18.7		 3galA-3wucA:
25.33
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) 		6 HIS A  45
ASN A  47
ARG A  49
ASN A  62
TRP A  69
GLU A  72
 GAL  A 202 (-3.8A)
GAL  A 202 (-4.0A)
GLC  A 201 (-2.7A)
GAL  A 202 (-3.9A)
GAL  A 202 (-3.9A)
GLC  A 201 (-2.7A)
 0.17A 3galA-3wudA:
19.6		 3galA-3wudA:
30.77
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.
3wv6 GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		4 HIS A  61
ASN A  63
ARG A  44
TRP A  82
 GAL  A 402 (-3.9A)
GAL  A 402 (-3.9A)
GAL  A 402 ( 4.9A)
GAL  A 402 (-3.7A)
 1.09A 3galA-3wv6A:
22.8		 3galA-3wv6A:
23.33
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.
3wv6 GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A  61
ASN A  63
ARG A  65
ASN A  75
TRP A  82
GLU A  85
 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)
 0.20A 3galA-3wv6A:
22.8		 3galA-3wv6A:
23.33
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.
3wv6 GALECTIN-9

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A 235
ASN A 237
ARG A 239
ASN A 248
TRP A 255
GLU A 258
 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)
 0.20A 3galA-3wv6A:
22.8		 3galA-3wv6A:
23.33
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) 		6 HIS A  49
ASN A  51
ARG A  53
ASN A  62
TRP A  69
GLU A  72
 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)
 0.29A 3galA-3zxeA:
27.1		 3galA-3zxeA:
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.
4agv GALECTIN

(Cinachyrella) 		PF00337
(Gal-bind_lectin) 		4 ARG A  47
ASN A  60
TRP A  68
GLU A  71
 None
 0.45A 3galA-4agvA:
18.6		 3galA-4agvA:
28.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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)
 0.25A 3galA-4bmbA:
23.3		 3galA-4bmbA:
32.00
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.
4bzg ALDOSE 1-EPIMERASE

(Bacillus
subtilis) 		PF01263
(Aldose_epim) 		4 HIS A  99
ASN A  92
ASN A  98
GLU A  93
 None
None
None
MAL  A 500 (-3.7A)
 1.44A 3galA-4bzgA:
undetectable		 3galA-4bzgA:
18.27
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.
4fqz GALECTIN-8

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		4 HIS A  65
ASN A  67
ARG A  45
TRP A  86
 GAL  A 401 (-4.0A)
GAL  A 401 (-4.2A)
GAL  A 401 (-2.8A)
GAL  A 401 (-3.5A)
 1.16A 3galA-4fqzA:
22.6		 3galA-4fqzA:
20.83
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)
 0.41A 3galA-4fqzA:
22.6		 3galA-4fqzA:
20.83
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 229
ASN A 231
ARG A 233
ASN A 242
TRP A 249
GLU A 252
 None
 0.38A 3galA-4fqzA:
22.6		 3galA-4fqzA:
20.83
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) 		4 HIS A  57
ASN A  70
TRP A  77
GLU A  80
 None
 0.41A 3galA-4hl0A:
22.6		 3galA-4hl0A:
19.22
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.
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
 0.27A 3galA-4hl0A:
22.6		 3galA-4hl0A:
19.22
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.
4jkm BETA-GLUCURONIDASE

(Clostridium
perfringens) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		4 HIS A 401
ARG A 341
ASN A 400
GLU A 269
 None
 1.44A 3galA-4jkmA:
undetectable		 3galA-4jkmA:
12.17
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)
 0.29A 3galA-4wvwA:
24.0		 3galA-4wvwA:
35.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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
 0.51A 3galA-4xzpA:
22.7		 3galA-4xzpA:
33.73
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) 		6 HIS A  44
ASN A  46
ARG A  48
ASN A  61
TRP A  68
GLU A  71
 GAL  A 201 (-3.9A)
GAL  A 201 (-4.4A)
6S2  A 202 (-2.8A)
GAL  A 201 (-3.8A)
GAL  A 201 ( 4.1A)
6S2  A 202 (-2.6A)
 0.49A 3galA-4y1yA:
20.0		 3galA-4y1yA:
33.12
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) 		6 HIS A  49
ASN A  51
ARG A  53
ASN A  62
TRP A  69
GLU A  72
 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)
 0.21A 3galA-4y26A:
27.2		 3galA-4y26A:
88.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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)
 0.27A 3galA-4ym3A:
22.8		 3galA-4ym3A:
36.77
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.
4zkt BONTOXILYSIN A

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 HIS A 956
ASN A 957
ASN A 955
GLU A 958
 None
 1.48A 3galA-4zktA:
6.3		 3galA-4zktA:
7.54
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.
4zwe DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1

(Homo sapiens) 		PF01966
(HD) 		4 HIS A 210
ASN A 207
ARG A 206
GLU A 234
 DGT  A 701 (-4.5A)
DGT  A 701 (-3.6A)
DGT  A 701 ( 4.2A)
None
 1.18A 3galA-4zweA:
undetectable		 3galA-4zweA:
16.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
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)
 0.25A 3galA-5duxB:
24.8		 3galA-5duxB:
36.42
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.
5ehk LANTIBIOTIC
DEHYDRATASE

(Microbispora
corallina) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		4 HIS A 803
ASN A 617
ARG A 620
GLU A 631
 None
 1.42A 3galA-5ehkA:
undetectable		 3galA-5ehkA:
8.36
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.
5f7c ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 ASN A 670
ASN A 667
TRP A 528
GLU A 669
 None
 1.44A 3galA-5f7cA:
undetectable		 3galA-5f7cA:
10.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gyl LEGUMIN-LIKE PROTEIN

(Cicer arietinum) 		PF00190
(Cupin_1) 		4 HIS A 187
ARG A  81
ASN A 186
GLU A 237
 None
 1.38A 3galA-5gylA:
undetectable		 3galA-5gylA:
15.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
 0.29A 3galA-5gzgA:
23.2		 3galA-5gzgA:
29.32
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) 		6 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
 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)
 0.19A 3galA-5h9pA:
23.0		 3galA-5h9pA:
35.22
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.
5izt OUTER SURFACE
PROTEIN

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		4 HIS A 295
ASN A 292
ASN A 294
GLU A 291
 None
 1.32A 3galA-5iztA:
undetectable		 3galA-5iztA:
15.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jp5 GALECTIN-5

(Rattus
norvegicus) 		PF00337
(Gal-bind_lectin) 		6 HIS A  57
ASN A  59
ARG A  61
ASN A  70
TRP A  77
GLU A  80
 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)
 0.41A 3galA-5jp5A:
23.0		 3galA-5jp5A:
39.86
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.
5mps PRE-MRNA-PROCESSING
FACTOR 17

(Saccharomyces
cerevisiae) 		PF00249
(Myb_DNA-binding) 		4 HIS o 345
ASN o 349
ASN o 343
TRP o 412
 None
U  I  60 ( 3.5A)
None
None
 1.49A 3galA-5mpso:
undetectable		 3galA-5mpso:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nfb GALECTIN-3

(Homo sapiens) 		PF00337
(Gal-bind_lectin) 		6 HIS A 158
ASN A 160
ARG A 162
ASN A 174
TRP A 181
GLU A 184
 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)
 0.21A 3galA-5nfbA:
22.9		 3galA-5nfbA:
29.55
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)
 0.20A 3galA-5nlhA:
22.3		 3galA-5nlhA:
33.70
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.
5td6 FOG-3 PROTEIN

(Caenorhabditis
elegans) 		PF07742
(BTG) 		4 HIS A  96
ARG A 100
ASN A  93
GLU A  53
 None
 1.07A 3galA-5td6A:
undetectable		 3galA-5td6A:
26.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fof GALECTIN-3,GALECTIN-
3

(Homo sapiens) 		no annotation 6 HIS C 158
ASN C 160
ARG C 162
ASN C 174
TRP C 181
GLU C 184
 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)
 0.26A 3galA-6fofC:
22.3		 3galA-6fofC:
undetectable