SIMILAR PATTERNS OF AMINO ACIDS FOR 3ZQ8_D_DVAD8

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.
1bg4 ENDO-1,4-BETA-XYLANA
SE

(Penicillium
simplicissimum) 		PF00331
(Glyco_hydro_10) 		3 TRP A 276
VAL A 267
TRP A 268
 GOL  A 629 (-4.4A)
None
GOL  A 629 ( 3.5A)
 0.97A 3zq8C-1bg4A:
undetectable
3zq8D-1bg4A:
undetectable		 3zq8C-1bg4A:
3.68
3zq8D-1bg4A:
3.68
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.
1bol PROTEIN
(RIBONUCLEASE RH)

(Rhizopus niveus) 		PF00445
(Ribonuclease_T2) 		3 TRP A  91
VAL A 100
TRP A 102
 None
 0.94A 3zq8C-1bolA:
undetectable
3zq8D-1bolA:
undetectable		 3zq8C-1bolA:
10.87
3zq8D-1bolA:
10.87
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.
1c3a FLAVOCETIN-A: ALPHA
SUBUNIT

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  69
VAL A  42
TRP A  25
 None
 1.08A 3zq8C-1c3aA:
undetectable
3zq8D-1c3aA:
undetectable		 3zq8C-1c3aA:
8.55
3zq8D-1c3aA:
8.55
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.
1cli PROTEIN
(PHOSPHORIBOSYL-AMIN
OIMIDAZOLE
SYNTHETASE)

(Escherichia
coli) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		3 TRP A 274
VAL A 279
TRP A 276
 None
 1.13A 3zq8C-1cliA:
undetectable
3zq8D-1cliA:
undetectable		 3zq8C-1cliA:
3.95
3zq8D-1cliA:
3.95
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.
1clx XYLANASE A

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 313
VAL A 304
TRP A 305
 None
 0.99A 3zq8C-1clxA:
undetectable
3zq8D-1clxA:
undetectable		 3zq8C-1clxA:
8.70
3zq8D-1clxA:
8.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dv8 ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 210
VAL A 189
TRP A 174
 None
 1.00A 3zq8C-1dv8A:
undetectable
3zq8D-1dv8A:
undetectable		 3zq8C-1dv8A:
15.94
3zq8D-1dv8A:
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.
1g1s P-SELECTIN

(Homo sapiens) 		PF00008
(EGF)
PF00059
(Lectin_C) 		3 TRP A  50
VAL A  27
TRP A  12
 None
MRD  A 807 ( 4.7A)
None
 1.06A 3zq8C-1g1sA:
undetectable
3zq8D-1g1sA:
undetectable		 3zq8C-1g1sA:
9.00
3zq8D-1g1sA:
9.00
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.
1ggm GLYCINE--TRNA LIGASE

(Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		3 TRP A 252
VAL A 257
TRP A 256
 None
 1.18A 3zq8C-1ggmA:
undetectable
3zq8D-1ggmA:
undetectable		 3zq8C-1ggmA:
5.80
3zq8D-1ggmA:
5.80
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.
1gom ENDO-1,4-BETA-XYLANA
SE

(Thermoascus
aurantiacus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 275
VAL A 266
TRP A 267
 None
 1.19A 3zq8C-1gomA:
undetectable
3zq8D-1gomA:
undetectable		 3zq8C-1gomA:
4.03
3zq8D-1gomA:
4.03
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.
1ijk BOTROCETIN

(Bothrops
jararaca) 		PF00059
(Lectin_C) 		3 TRP B  68
VAL B  40
TRP B  23
 None
 1.02A 3zq8C-1ijkB:
undetectable
3zq8D-1ijkB:
undetectable		 3zq8C-1ijkB:
12.20
3zq8D-1ijkB:
12.20
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.
1ixx COAGULATION FACTORS
IX/X-BINDING PROTEIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A  40
TRP A  23
 None
 0.96A 3zq8C-1ixxA:
undetectable
3zq8D-1ixxA:
undetectable		 3zq8C-1ixxA:
11.49
3zq8D-1ixxA:
11.49
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.
1j2r HYPOTHETICAL
ISOCHORISMATASE
FAMILY PROTEIN YECD

(Escherichia
coli) 		PF00857
(Isochorismatase) 		3 TRP A  95
VAL A  89
TRP A  94
 None
 0.91A 3zq8C-1j2rA:
undetectable
3zq8D-1j2rA:
undetectable		 3zq8C-1j2rA:
8.00
3zq8D-1j2rA:
8.00
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.
1k9j MDC-SIGN2 TYPE I
ISOFORM

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 327
VAL A 304
TRP A 289
 None
 0.98A 3zq8C-1k9jA:
undetectable
3zq8D-1k9jA:
undetectable		 3zq8C-1k9jA:
18.18
3zq8D-1k9jA:
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.
1m53 ISOMALTULOSE
SYNTHASE

(Klebsiella sp.
LX3) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 384
VAL A 374
TRP A 590
 None
 1.17A 3zq8C-1m53A:
undetectable
3zq8D-1m53A:
undetectable		 3zq8C-1m53A:
4.64
3zq8D-1m53A:
4.64
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.
1mwo ALPHA AMYLASE

(Pyrococcus
woesei) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		3 TRP A 214
VAL A 208
TRP A 177
 None
 1.06A 3zq8C-1mwoA:
undetectable
3zq8D-1mwoA:
undetectable		 3zq8C-1mwoA:
5.71
3zq8D-1mwoA:
5.71
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.
1nq6 XYS1

(Streptomyces
halstedii) 		PF00331
(Glyco_hydro_10) 		3 TRP A 276
VAL A 267
TRP A 268
 None
 0.88A 3zq8C-1nq6A:
undetectable
3zq8D-1nq6A:
undetectable		 3zq8C-1nq6A:
9.76
3zq8D-1nq6A:
9.76
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.
1oz7 ECHICETIN B-CHAIN

(Echis carinatus) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B  40
TRP B  23
 None
 1.13A 3zq8C-1oz7B:
undetectable
3zq8D-1oz7B:
undetectable		 3zq8C-1oz7B:
26.67
3zq8D-1oz7B:
26.67
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.
1oz7 ECHICETIN A-CHAIN
ECHICETIN B-CHAIN

(Echis
carinatus;
Echis carinatus) 		PF00059
(Lectin_C)
PF00059
(Lectin_C) 		3 TRP B  90
VAL A 113
TRP B  72
 None
 1.19A 3zq8C-1oz7B:
undetectable
3zq8D-1oz7B:
undetectable		 3zq8C-1oz7B:
26.67
3zq8D-1oz7B:
26.67
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.
1qdd LITHOSTATHINE

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A  77
VAL A  51
TRP A  35
 None
 0.93A 3zq8C-1qddA:
undetectable
3zq8D-1qddA:
undetectable		 3zq8C-1qddA:
17.54
3zq8D-1qddA:
17.54
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.
1sl5 MDC-SIGN1B TYPE I
ISOFORM

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 315
VAL A 292
TRP A 277
 None
 0.96A 3zq8C-1sl5A:
undetectable
3zq8D-1sl5A:
undetectable		 3zq8C-1sl5A:
20.45
3zq8D-1sl5A:
20.45
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.
1sl6 C-TYPE LECTIN
DC-SIGNR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 327
VAL A 304
TRP A 289
 None
 0.97A 3zq8C-1sl6A:
undetectable
3zq8D-1sl6A:
undetectable		 3zq8C-1sl6A:
10.48
3zq8D-1sl6A:
10.48
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.
1u0o BOTROCETIN

(Bothrops
jararaca) 		PF00059
(Lectin_C) 		3 TRP B 265
VAL B 240
TRP B 223
 None
 0.94A 3zq8C-1u0oB:
undetectable
3zq8D-1u0oB:
undetectable		 3zq8C-1u0oB:
9.17
3zq8D-1u0oB:
9.17
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.
1ukm EMS16 A CHAIN

(Echis
multisquamatus) 		PF00059
(Lectin_C) 		3 TRP A  69
VAL A  42
TRP A  25
 None
 0.92A 3zq8C-1ukmA:
undetectable
3zq8D-1ukmA:
undetectable		 3zq8C-1ukmA:
9.91
3zq8D-1ukmA:
9.91
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.
1umr CONVULXIN BETA

(Crotalus
durissus) 		PF00059
(Lectin_C) 		3 TRP C 267
VAL C 242
TRP C 225
 None
 0.97A 3zq8C-1umrC:
undetectable
3zq8D-1umrC:
undetectable		 3zq8C-1umrC:
10.19
3zq8D-1umrC:
10.19
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.
1us2 ENDO-BETA-1,4-XYLANA
SE

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10)
PF03426
(CBM_15) 		3 TRP A 560
VAL A 551
TRP A 552
 XYP  A1609 ( 4.0A)
None
XYP  A1609 ( 4.1A)
 0.95A 3zq8C-1us2A:
undetectable
3zq8D-1us2A:
undetectable		 3zq8C-1us2A:
3.14
3zq8D-1us2A:
3.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ux6 THROMBOSPONDIN-1

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		3 TRP A1022
VAL A1025
TRP A1084
 None
 0.91A 3zq8C-1ux6A:
undetectable
3zq8D-1ux6A:
undetectable		 3zq8C-1ux6A:
4.41
3zq8D-1ux6A:
4.41
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.
1v0m ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
lividans) 		PF00331
(Glyco_hydro_10) 		3 TRP A 274
VAL A 265
TRP A 266
 XDN  A1303 ( 4.1A)
None
XDN  A1303 ( 4.1A)
 0.89A 3zq8C-1v0mA:
undetectable
3zq8D-1v0mA:
undetectable		 3zq8C-1v0mA:
4.12
3zq8D-1v0mA:
4.12
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.
1v4l MUCROCETIN BETA
CHAIN

(Protobothrops
mucrosquamatus) 		PF00059
(Lectin_C) 		3 TRP B 267
VAL B 242
TRP B 225
 None
 1.02A 3zq8C-1v4lB:
undetectable
3zq8D-1v4lB:
undetectable		 3zq8C-1v4lB:
8.00
3zq8D-1v4lB:
8.00
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.
1v6u ENDO-1,4-BETA-D-XYLA
NASE

(Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10)
PF00652
(Ricin_B_lectin) 		3 TRP A 274
VAL A 265
TRP A 266
 XYP  A 452 (-4.3A)
None
XYP  A 451 ( 4.1A)
 0.93A 3zq8C-1v6uA:
undetectable
3zq8D-1v6uA:
undetectable		 3zq8C-1v6uA:
5.11
3zq8D-1v6uA:
5.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v6y ENDO-1,4-BETA-D-XYLA
NASE AND
ENDO-1,4-BETA-XYLANA
SE B

(Cellulomonas
fimi;
Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10) 		3 TRP A 283
VAL A 274
TRP A 275
 None
 0.90A 3zq8C-1v6yA:
undetectable
3zq8D-1v6yA:
undetectable		 3zq8C-1v6yA:
4.71
3zq8D-1v6yA:
4.71
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.
1wmy LECTIN CEL-I,
N-ACETYL-D-GALACTOSA
MINE-SPECIFIC C-TYPE

(Cucumaria
echinata) 		PF00059
(Lectin_C) 		3 TRP A  72
VAL A  46
TRP A  24
 None
 1.05A 3zq8C-1wmyA:
undetectable
3zq8D-1wmyA:
undetectable		 3zq8C-1wmyA:
17.02
3zq8D-1wmyA:
17.02
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.
1wt9 ANTICOAGULANT
PROTEIN-B

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B  40
TRP B  23
 None
 0.96A 3zq8C-1wt9B:
undetectable
3zq8D-1wt9B:
undetectable		 3zq8C-1wt9B:
13.75
3zq8D-1wt9B:
13.75
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.
1x2w COAGULATION FACTOR
IX/FACTOR X-BINDING
PROTEIN B CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B  40
TRP B  23
 None
 1.03A 3zq8C-1x2wB:
undetectable
3zq8D-1x2wB:
undetectable		 3zq8C-1x2wB:
13.75
3zq8D-1x2wB:
13.75
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.
1x2w COAGULATION FACTOR
IX/X-BINDING PROTEIN
A CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A  40
TRP A  23
 None
 1.05A 3zq8C-1x2wA:
undetectable
3zq8D-1x2wA:
undetectable		 3zq8C-1x2wA:
10.43
3zq8D-1x2wA:
10.43
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.
1y17 ANTICOAGULANT
PROTEIN A

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A  40
TRP A  23
 None
 0.89A 3zq8C-1y17A:
undetectable
3zq8D-1y17A:
undetectable		 3zq8C-1y17A:
9.57
3zq8D-1y17A:
9.57
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.
1yr2 PROLYL
OLIGOPEPTIDASE

(Novosphingobium
capsulatum) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 TRP A  77
VAL A  46
TRP A  61
 None
 1.25A 3zq8C-1yr2A:
undetectable
3zq8D-1yr2A:
undetectable		 3zq8C-1yr2A:
4.46
3zq8D-1yr2A:
4.46
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.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
LIGHT CHAIN 1

(Daboia
siamensis) 		PF00059
(Lectin_C) 		3 TRP C  67
VAL C  42
TRP C  25
 None
 1.02A 3zq8C-2e3xC:
undetectable
3zq8D-2e3xC:
undetectable		 3zq8C-2e3xC:
13.51
3zq8D-2e3xC:
13.51
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.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
LIGHT CHAIN 2

(Daboia
siamensis) 		PF00059
(Lectin_C) 		3 TRP B  67
VAL B  40
TRP B  23
 None
 1.15A 3zq8C-2e3xB:
undetectable
3zq8D-2e3xB:
undetectable		 3zq8C-2e3xB:
10.00
3zq8D-2e3xB:
10.00
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.
2e8p ELF3 PROTEIN

(Homo sapiens) 		PF02198
(SAM_PNT) 		3 TRP A  19
VAL A  40
TRP A  35
 None
 1.12A 3zq8C-2e8pA:
undetectable
3zq8D-2e8pA:
undetectable		 3zq8C-2e8pA:
13.11
3zq8D-2e8pA:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fv0 UNSATURATED
GLUCURONYL HYDROLASE

(Bacillus sp.
GL1) 		PF07470
(Glyco_hydro_88) 		3 TRP A 159
VAL A 103
TRP A 101
 None
 1.01A 3zq8C-2fv0A:
undetectable
3zq8D-2fv0A:
undetectable		 3zq8C-2fv0A:
3.75
3zq8D-2fv0A:
3.75
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.
2h2t LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR
(LYMPHOCYTE IGE
RECEPTOR)
(FC-EPSILON-RII)
(IMMUNOGLOBULIN
E-BINDING FACTOR)
(CD23 ANTIGEN)

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP B 220
VAL B 199
TRP B 184
 None
 0.90A 3zq8C-2h2tB:
undetectable
3zq8D-2h2tB:
undetectable		 3zq8C-2h2tB:
4.38
3zq8D-2h2tB:
4.38
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.
2his CELLULOMONAS FIMI
FAMILY 10
BETA-1,4-GLYCANASE

(Cellulomonas
fimi) 		PF00331
(Glyco_hydro_10) 		3 TRP A 281
VAL A 272
TRP A 273
 GLC  A 602 ( 3.4A)
None
GLC  A 602 ( 4.1A)
 1.16A 3zq8C-2hisA:
undetectable
3zq8D-2hisA:
undetectable		 3zq8C-2hisA:
9.76
3zq8D-2hisA:
9.76
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.
2it6 CD209 ANTIGEN

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 315
VAL A 292
TRP A 277
 None
 0.93A 3zq8C-2it6A:
undetectable
3zq8D-2it6A:
undetectable		 3zq8C-2it6A:
20.45
3zq8D-2it6A:
20.45
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.
2ozg GCN5-RELATED
N-ACETYLTRANSFERASE

(Trichormus
variabilis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		3 TRP A 233
VAL A 138
TRP A 260
 None
 1.01A 3zq8C-2ozgA:
undetectable
3zq8D-2ozgA:
undetectable		 3zq8C-2ozgA:
5.91
3zq8D-2ozgA:
5.91
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.
2pwh SUCROSE ISOMERASE

([Pseudomonas]
mesoacidophila) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		3 TRP A 342
VAL A 332
TRP A 549
 None
 1.16A 3zq8C-2pwhA:
undetectable
3zq8D-2pwhA:
undetectable		 3zq8C-2pwhA:
1.82
3zq8D-2pwhA:
1.82
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.
2rf4 DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA4

(Saccharomyces
cerevisiae) 		PF03876
(SHS2_Rpb7-N) 		3 TRP A 166
VAL A 169
TRP A 217
 None
 1.04A 3zq8C-2rf4A:
undetectable
3zq8D-2rf4A:
undetectable		 3zq8C-2rf4A:
5.69
3zq8D-2rf4A:
5.69
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		3 TRP A1042
VAL A1045
TRP A1104
 None
 0.92A 3zq8C-2rhpA:
undetectable
3zq8D-2rhpA:
undetectable		 3zq8C-2rhpA:
2.70
3zq8D-2rhpA:
2.70
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.
2vca ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C)
PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		3 TRP A 548
VAL A 544
TRP A 560
 None
 1.06A 3zq8C-2vcaA:
undetectable
3zq8D-2vcaA:
undetectable		 3zq8C-2vcaA:
2.28
3zq8D-2vcaA:
2.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vrp AGGRETIN BETA CHAIN

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B  40
TRP B  23
 None
 1.05A 3zq8C-2vrpB:
undetectable
3zq8D-2vrpB:
undetectable		 3zq8C-2vrpB:
12.50
3zq8D-2vrpB:
12.50
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.
2w5f ENDO-1,4-BETA-XYLANA
SE Y

(Ruminiclostridium
thermocellum) 		PF00331
(Glyco_hydro_10)
PF02018
(CBM_4_9) 		3 TRP A 512
VAL A 503
TRP A 504
 XYP  A1001 (-4.0A)
None
XYP  A1002 (-4.2A)
 0.92A 3zq8C-2w5fA:
undetectable
3zq8D-2w5fA:
undetectable		 3zq8C-2w5fA:
3.81
3zq8D-2w5fA:
3.81
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.
2xyu EPHRIN TYPE-A
RECEPTOR 4,

(Mus musculus) 		PF07714
(Pkinase_Tyr) 		3 TRP A 808
VAL A 813
TRP A 861
 None
 1.26A 3zq8C-2xyuA:
undetectable
3zq8D-2xyuA:
undetectable		 3zq8C-2xyuA:
6.47
3zq8D-2xyuA:
6.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bx4 AGGRETIN BETA CHAIN

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B  40
TRP B  23
 None
 1.02A 3zq8C-3bx4B:
undetectable
3zq8D-3bx4B:
undetectable		 3zq8C-3bx4B:
9.71
3zq8D-3bx4B:
9.71
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.
3dko EPHRIN TYPE-A
RECEPTOR 7

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM) 		3 TRP A 820
VAL A 825
TRP A 873
 None
 1.27A 3zq8C-3dkoA:
undetectable
3zq8D-3dkoA:
undetectable		 3zq8C-3dkoA:
4.72
3zq8D-3dkoA:
4.72
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.
3dn7 CYCLIC NUCLEOTIDE
BINDING REGULATORY
PROTEIN

(Cytophaga
hutchinsonii) 		PF00027
(cNMP_binding) 		3 TRP A  77
VAL A  52
TRP A  78
 None
 0.78A 3zq8C-3dn7A:
undetectable
3zq8D-3dn7A:
undetectable		 3zq8C-3dn7A:
11.90
3zq8D-3dn7A:
11.90
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 357
VAL A 347
TRP A 564
 None
 1.11A 3zq8C-3gbdA:
undetectable
3zq8D-3gbdA:
undetectable		 3zq8C-3gbdA:
2.19
3zq8D-3gbdA:
2.19
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.
3gpr RHODOCETIN SUBUNIT
ALPHA

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP A1067
VAL A1040
TRP A1023
 None
 1.24A 3zq8C-3gprA:
undetectable
3zq8D-3gprA:
undetectable		 3zq8C-3gprA:
7.52
3zq8D-3gprA:
7.52
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.
3llr DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 3A

(Homo sapiens) 		PF00855
(PWWP) 		3 TRP A  39
VAL A  37
TRP A  40
 None
 1.07A 3zq8C-3llrA:
undetectable
3zq8D-3llrA:
undetectable		 3zq8C-3llrA:
7.83
3zq8D-3llrA:
7.83
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.
3nfv ALGINATE LYASE

(Bacteroides
ovatus) 		PF05426
(Alginate_lyase) 		3 TRP A 216
VAL A 151
TRP A 152
 None
 1.21A 3zq8C-3nfvA:
undetectable
3zq8D-3nfvA:
undetectable		 3zq8C-3nfvA:
3.06
3zq8D-3nfvA:
3.06
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.
3qgv ALPHA AMYLASE

(Pyrococcus
woesei) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		3 TRP A 214
VAL A 208
TRP A 177
 None
 1.17A 3zq8C-3qgvA:
undetectable
3zq8D-3qgvA:
undetectable		 3zq8C-3qgvA:
4.35
3zq8D-3qgvA:
4.35
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.
3u3i NUCLEOCAPSID PROTEIN

(Crimean-Congo
hemorrhagic
fever
orthonairovirus) 		PF02477
(Nairo_nucleo) 		3 TRP A  95
VAL A  89
TRP A 133
 None
 1.10A 3zq8C-3u3iA:
undetectable
3zq8D-3u3iA:
undetectable		 3zq8C-3u3iA:
3.81
3zq8D-3u3iA:
3.81
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.
3u7b ENDO-1,4-BETA-XYLANA
SE

(Fusarium
oxysporum) 		PF00331
(Glyco_hydro_10) 		3 TRP A 293
VAL A 284
TRP A 285
 None
 1.20A 3zq8C-3u7bA:
undetectable
3zq8D-3u7bA:
undetectable		 3zq8C-3u7bA:
3.99
3zq8D-3u7bA:
3.99
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.
3ubu AGGLUCETIN SUBUNIT
ALPHA-1

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A  42
TRP A  25
 None
 0.89A 3zq8C-3ubuA:
undetectable
3zq8D-3ubuA:
undetectable		 3zq8C-3ubuA:
9.23
3zq8D-3ubuA:
9.23
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.
3ubu AGGLUCETIN SUBUNIT
BETA-2

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  67
VAL B  42
TRP B  25
 None
 1.05A 3zq8C-3ubuB:
undetectable
3zq8D-3ubuB:
undetectable		 3zq8C-3ubuB:
9.17
3zq8D-3ubuB:
9.17
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.
3ugg SUCROSE:(SUCROSE/FRU
CTAN)
6-FRUCTOSYLTRANSFERA
SE

(Pachysandra
terminalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 TRP A  30
VAL A  91
TRP A  57
 None
None
DQR  A 800 ( 3.9A)
 1.18A 3zq8C-3uggA:
undetectable
3zq8D-3uggA:
undetectable		 3zq8C-3uggA:
4.17
3zq8D-3uggA:
4.17
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.
3wuf ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
sp.) 		PF00331
(Glyco_hydro_10) 		3 TRP A 319
VAL A 310
TRP A 311
 None
 1.00A 3zq8C-3wufA:
undetectable
3zq8D-3wufA:
undetectable		 3zq8C-3wufA:
10.53
3zq8D-3wufA:
10.53
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.
4aw5 EPHRIN TYPE-B
RECEPTOR 4

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 TRP A 280
VAL A 285
TRP A 333
 None
 1.26A 3zq8C-4aw5A:
undetectable
3zq8D-4aw5A:
undetectable		 3zq8C-4aw5A:
4.45
3zq8D-4aw5A:
4.45
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.
4c9f CD209 ANTIGEN-LIKE
PROTEIN B

(Mus musculus) 		PF00059
(Lectin_C) 		3 TRP A 253
VAL A 231
TRP A 216
 None
 0.94A 3zq8C-4c9fA:
undetectable
3zq8D-4c9fA:
undetectable		 3zq8C-4c9fA:
18.37
3zq8D-4c9fA:
18.37
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.
4caj CD209 ANTIGEN-LIKE
PROTEIN B

(Mus musculus) 		PF00059
(Lectin_C) 		3 TRP A 253
VAL A 231
TRP A 216
 None
 0.95A 3zq8C-4cajA:
undetectable
3zq8D-4cajA:
undetectable		 3zq8C-4cajA:
14.13
3zq8D-4cajA:
14.13
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.
4d7e L-LYS MONOOXYGENASE

(Nocardia
farcinica) 		PF13434
(K_oxygenase) 		3 TRP A  45
VAL A 116
TRP A 117
 FAD  A 500 (-4.4A)
None
None
 0.90A 3zq8C-4d7eA:
undetectable
3zq8D-4d7eA:
undetectable		 3zq8C-4d7eA:
4.17
3zq8D-4d7eA:
4.17
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.
4f8x ENDO-1,4-BETA-XYLANA
SE

(Penicillium
canescens) 		PF00331
(Glyco_hydro_10) 		3 TRP A 321
VAL A 312
TRP A 313
 None
 1.13A 3zq8C-4f8xA:
undetectable
3zq8D-4f8xA:
undetectable		 3zq8C-4f8xA:
4.08
3zq8D-4f8xA:
4.08
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.
4hvi TYROSINE-PROTEIN
KINASE JAK3

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 TRP A1011
VAL A1016
TRP A1078
 None
 1.25A 3zq8C-4hviA:
undetectable
3zq8D-4hviA:
undetectable		 3zq8C-4hviA:
5.28
3zq8D-4hviA:
5.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j6p LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 220
VAL A 199
TRP A 184
 None
 0.93A 3zq8C-4j6pA:
undetectable
3zq8D-4j6pA:
undetectable		 3zq8C-4j6pA:
10.00
3zq8D-4j6pA:
10.00
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.
4lgn CELLULOSE-BINDING,
FAMILY II

(Acidothermus
cellulolyticus) 		no annotation 3 TRP A  61
VAL A 674
TRP A 707
 None
 1.24A 3zq8C-4lgnA:
undetectable
3zq8D-4lgnA:
undetectable		 3zq8C-4lgnA:
2.36
3zq8D-4lgnA:
2.36
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.
4pmu ENDO-1,4-BETA-XYLANA
SE A

(Xanthomonas
citri) 		PF00331
(Glyco_hydro_10) 		3 TRP A 342
VAL A 333
TRP A 334
 None
 0.89A 3zq8C-4pmuA:
undetectable
3zq8D-4pmuA:
undetectable		 3zq8C-4pmuA:
4.46
3zq8D-4pmuA:
4.46
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.
4rml LATROPHILIN-3

(Mus musculus) 		PF02191
(OLF) 		3 TRP A 447
VAL A 435
TRP A 226
 None
 1.09A 3zq8C-4rmlA:
undetectable
3zq8D-4rmlA:
undetectable		 3zq8C-4rmlA:
3.64
3zq8D-4rmlA:
3.64
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.
4uac CARBOHYDRATE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT1 FAMILY
(TC 3.A.1.1.-)

([Eubacterium]
rectale) 		PF13416
(SBP_bac_8) 		3 TRP A 193
VAL A 372
TRP A 159
 ACR  A 501 (-3.1A)
PEG  A 502 (-4.4A)
None
 1.22A 3zq8C-4uacA:
undetectable
3zq8D-4uacA:
undetectable		 3zq8C-4uacA:
2.95
3zq8D-4uacA:
2.95
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.
4xuy PROBABLE
ENDO-1,4-BETA-XYLANA
SE C

(Aspergillus
niger) 		PF00331
(Glyco_hydro_10) 		3 TRP A 301
VAL A 292
TRP A 293
 None
 1.05A 3zq8C-4xuyA:
undetectable
3zq8D-4xuyA:
undetectable		 3zq8C-4xuyA:
3.68
3zq8D-4xuyA:
3.68
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.
4xv0 BETA-XYLANASE

(Trichoderma
reesei) 		PF00331
(Glyco_hydro_10) 		3 TRP A 320
VAL A 311
TRP A 312
 None
 0.94A 3zq8C-4xv0A:
undetectable
3zq8D-4xv0A:
undetectable		 3zq8C-4xv0A:
4.23
3zq8D-4xv0A:
4.23
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.
4xz8 NUCLEOPROTEIN

(Thiafora
orthonairovirus) 		PF02477
(Nairo_nucleo) 		3 TRP A  95
VAL A  89
TRP A 137
 None
 1.10A 3zq8C-4xz8A:
undetectable
3zq8D-4xz8A:
undetectable		 3zq8C-4xz8A:
4.58
3zq8D-4xz8A:
4.58
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.
4xzc NUCLEOPROTEIN

(Nairobi sheep
disease
orthonairovirus) 		PF02477
(Nairo_nucleo) 		3 TRP A  95
VAL A  89
TRP A 133
 None
 1.11A 3zq8C-4xzcA:
undetectable
3zq8D-4xzcA:
undetectable		 3zq8C-4xzcA:
4.15
3zq8D-4xzcA:
4.15
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.
4xze NUCLEOPROTEIN

(Hazara
orthonairovirus) 		PF02477
(Nairo_nucleo) 		3 TRP A  95
VAL A  89
TRP A 135
 None
 1.15A 3zq8C-4xzeA:
undetectable
3zq8D-4xzeA:
undetectable		 3zq8C-4xzeA:
3.73
3zq8D-4xzeA:
3.73
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.
5anb ELONGATION FACTOR TU
GTP-BINDING
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF14492
(EFG_II) 		3 TRP K 848
VAL K 820
TRP K 801
 None
 0.88A 3zq8C-5anbK:
undetectable
3zq8D-5anbK:
undetectable		 3zq8C-5anbK:
1.54
3zq8D-5anbK:
1.54
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.
5ao5 C-TYPE MANNOSE
RECEPTOR 2

(Homo sapiens) 		PF00040
(fn2)
PF00059
(Lectin_C) 		3 TRP A 441
VAL A 418
TRP A 403
 None
 0.93A 3zq8C-5ao5A:
undetectable
3zq8D-5ao5A:
undetectable		 3zq8C-5ao5A:
3.25
3zq8D-5ao5A:
3.25
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.
5b4c UDP-2,3-DIACYLGLUCOS
AMINE HYDROLASE

(Pseudomonas
aeruginosa) 		PF00149
(Metallophos) 		3 TRP A 219
VAL A 215
TRP A 224
 None
 1.27A 3zq8C-5b4cA:
undetectable
3zq8D-5b4cA:
undetectable		 3zq8C-5b4cA:
8.70
3zq8D-5b4cA:
8.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cmn LATROPHILIN-3

(Homo sapiens) 		PF02191
(OLF) 		3 TRP E 379
VAL E 367
TRP E 158
 None
CA  E 401 (-4.8A)
None
 1.16A 3zq8C-5cmnE:
undetectable
3zq8D-5cmnE:
undetectable		 3zq8C-5cmnE:
4.23
3zq8D-5cmnE:
4.23
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.
5fkc BETA-FRUCTOFURANOSID
ASE

(Xanthophyllomyces
dendrorhous) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 TRP A  77
VAL A 144
TRP A 105
 None
None
GLA  A3003 ( 3.7A)
 1.16A 3zq8C-5fkcA:
undetectable
3zq8D-5fkcA:
undetectable		 3zq8C-5fkcA:
16.92
3zq8D-5fkcA:
16.92
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.
5ftt ADHESION G
PROTEIN-COUPLED
RECEPTOR L3

(Mus musculus) 		PF02140
(Gal_Lectin)
PF02191
(OLF) 		3 TRP C 447
VAL C 435
TRP C 226
 None
CA  C1467 (-4.8A)
None
 1.24A 3zq8C-5fttC:
undetectable
3zq8D-5fttC:
undetectable		 3zq8C-5fttC:
5.14
3zq8D-5fttC:
5.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ja1 ENTEROBACTIN
SYNTHASE COMPONENT F

(Escherichia
coli) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		3 TRP A 780
VAL A 755
TRP A 626
 None
 1.01A 3zq8C-5ja1A:
undetectable
3zq8D-5ja1A:
undetectable		 3zq8C-5ja1A:
2.26
3zq8D-5ja1A:
2.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jpv ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 210
VAL A 189
TRP A 174
 None
 0.97A 3zq8C-5jpvA:
undetectable
3zq8D-5jpvA:
undetectable		 3zq8C-5jpvA:
12.82
3zq8D-5jpvA:
12.82
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.
5k47 POLYCYSTIN-2

(Homo sapiens) 		PF08016
(PKD_channel) 		3 TRP A 366
VAL A 406
TRP A 414
 None
 1.15A 3zq8C-5k47A:
undetectable
3zq8D-5k47A:
undetectable		 3zq8C-5k47A:
4.04
3zq8D-5k47A:
4.04
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.
5lgk LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP E 220
VAL E 199
TRP E 184
 None
 0.91A 3zq8C-5lgkE:
undetectable
3zq8D-5lgkE:
undetectable		 3zq8C-5lgkE:
8.25
3zq8D-5lgkE:
8.25
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.
5m0k BETA-XYLANASE

(Cellulomonas
flavigena) 		no annotation 3 TRP A 273
VAL A 264
TRP A 265
 None
 0.91A 3zq8C-5m0kA:
undetectable
3zq8D-5m0kA:
undetectable		 3zq8C-5m0kA:
undetectable
3zq8D-5m0kA:
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.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 TRP A 268
VAL A 276
TRP A 237
 None
 1.24A 3zq8C-5mdnA:
undetectable
3zq8D-5mdnA:
undetectable		 3zq8C-5mdnA:
1.80
3zq8D-5mdnA:
1.80
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.
5mrj BETA-XYLANASE

(Acremonium
chrysogenum) 		no annotation 3 TRP A 370
VAL A 361
TRP A 362
 None
 0.95A 3zq8C-5mrjA:
undetectable
3zq8D-5mrjA:
undetectable		 3zq8C-5mrjA:
undetectable
3zq8D-5mrjA:
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.
5t1d GLYCOPROTEIN 42

(Human
gammaherpesvirus
4) 		no annotation 3 TRP C 163
VAL C 166
TRP C 125
 None
 1.25A 3zq8C-5t1dC:
undetectable
3zq8D-5t1dC:
undetectable		 3zq8C-5t1dC:
7.58
3zq8D-5t1dC:
7.58
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.
5vc1 L-SELECTIN

(Homo sapiens) 		PF00008
(EGF)
PF00059
(Lectin_C) 		3 TRP A  50
VAL A  27
TRP A  12
 None
 0.99A 3zq8C-5vc1A:
undetectable
3zq8D-5vc1A:
undetectable		 3zq8C-5vc1A:
5.26
3zq8D-5vc1A:
5.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vg9 PROTEIN-S-ISOPRENYLC
YSTEINE
O-METHYLTRANSFERASE

(Tribolium
castaneum) 		no annotation 3 TRP A 218
VAL A 213
TRP A 215
 None
 1.20A 3zq8C-5vg9A:
undetectable
3zq8D-5vg9A:
undetectable		 3zq8C-5vg9A:
undetectable
3zq8D-5vg9A:
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.
5wze AMINOPEPTIDASE P

(Pseudomonas
aeruginosa) 		no annotation 3 TRP A 372
VAL A 374
TRP A 310
 None
 1.23A 3zq8C-5wzeA:
undetectable
3zq8D-5wzeA:
undetectable		 3zq8C-5wzeA:
undetectable
3zq8D-5wzeA:
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.
5xzu BETA-XYLANASE

(Bispora sp.
MEY-1) 		no annotation 3 TRP A 297
VAL A 288
TRP A 289
 CBI  A 404 (-4.2A)
None
CBI  A 404 (-4.0A)
 0.96A 3zq8C-5xzuA:
undetectable
3zq8D-5xzuA:
undetectable		 3zq8C-5xzuA:
undetectable
3zq8D-5xzuA:
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.
6cfw MBH13 NADH
DEHYDROGENASE
SUBUNIT

(Pyrococcus
furiosus) 		no annotation 3 TRP M 252
VAL M 248
TRP M 175
 None
 1.24A 3zq8C-6cfwM:
undetectable
3zq8D-6cfwM:
undetectable		 3zq8C-6cfwM:
undetectable
3zq8D-6cfwM:
undetectable