SIMILAR PATTERNS OF AMINO ACIDS FOR 5JHD_E_EDTE301

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.
1eww ANTIFREEZE PROTEIN

(Choristoneura
fumiferana) 		PF05264
(CfAFP) 		4 SER A  50
THR A  35
THR A  48
ILE A  57
 None
 0.99A 5jhdE-1ewwA:
undetectable
5jhdG-1ewwA:
undetectable		 5jhdE-1ewwA:
15.48
5jhdG-1ewwA:
22.92
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.
1f9k ACIDIC LECTIN

(Psophocarpus
tetragonolobus) 		PF00139
(Lectin_legB) 		4 TYR A 215
THR A 212
THR A  47
PRO A 113
 AMG  A 400 (-4.6A)
None
None
None
 1.12A 5jhdE-1f9kA:
1.4
5jhdG-1f9kA:
0.3		 5jhdE-1f9kA:
22.56
5jhdG-1f9kA:
16.03
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.
1h71 SERRALYSIN

(Pseudomonas sp.
'TAC II 18') 		PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		4 SER P   5
THR P   4
THR P 402
ILE P  11
 None
 1.09A 5jhdE-1h71P:
0.0
5jhdG-1h71P:
0.1		 5jhdE-1h71P:
21.03
5jhdG-1h71P:
9.94
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.
1iwp GLYCEROL DEHYDRATASE
ALPHA SUBUNIT

(Klebsiella
pneumoniae) 		PF02286
(Dehydratase_LU) 		4 TYR A 502
SER A 219
THR A 200
ILE A 490
 None
 1.02A 5jhdE-1iwpA:
undetectable
5jhdG-1iwpA:
undetectable		 5jhdE-1iwpA:
18.78
5jhdG-1iwpA:
9.55
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.
1js8 HEMOCYANIN

(Enteroctopus
dofleini) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 SER A2687
THR A2688
ARG A2629
PRO A2631
 None
 1.10A 5jhdE-1js8A:
0.7
5jhdG-1js8A:
undetectable		 5jhdE-1js8A:
20.40
5jhdG-1js8A:
12.53
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.
1o5w AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Rattus
norvegicus) 		PF01593
(Amino_oxidase) 		4 SER A 442
THR A 408
PRO A 143
ILE A 423
 None
 0.98A 5jhdE-1o5wA:
0.0
5jhdG-1o5wA:
0.0		 5jhdE-1o5wA:
18.84
5jhdG-1o5wA:
11.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 TYR A 148
THR A 163
THR A 165
PRO A 154
 None
 0.96A 5jhdE-1obbA:
undetectable
5jhdG-1obbA:
0.0		 5jhdE-1obbA:
19.60
5jhdG-1obbA:
11.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1px8 BETA-XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum) 		PF01229
(Glyco_hydro_39) 		4 TYR A 230
ARG A 324
PRO A 284
ILE A 242
 None
 1.14A 5jhdE-1px8A:
undetectable
5jhdG-1px8A:
undetectable		 5jhdE-1px8A:
18.81
5jhdG-1px8A:
12.55
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.
1qdm PROPHYTEPSIN

(Hordeum vulgare) 		PF00026
(Asp)
PF03489
(SapB_2)
PF05184
(SapB_1) 		4 TYR A  18
LYS A  12
THR A 226
PRO A 320
 None
 1.02A 5jhdE-1qdmA:
undetectable
5jhdG-1qdmA:
undetectable		 5jhdE-1qdmA:
20.29
5jhdG-1qdmA:
11.76
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.
1t6r PUTATIVE ANTI-SIGMA
FACTOR ANTAGONIST
TM1442

(Thermotoga
maritima) 		PF01740
(STAS) 		4 SER A  82
THR A 104
ARG A  18
ILE A  16
 None
 1.03A 5jhdE-1t6rA:
undetectable
5jhdG-1t6rA:
undetectable		 5jhdE-1t6rA:
21.01
5jhdG-1t6rA:
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.
1t71 PHOSPHATASE

(Mycoplasma
pneumoniae) 		PF13277
(YmdB) 		4 LYS A 255
SER A 198
THR A 194
ILE A 179
 None
 1.07A 5jhdE-1t71A:
undetectable
5jhdG-1t71A:
undetectable		 5jhdE-1t71A:
23.39
5jhdG-1t71A:
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.
1thg LIPASE 2

(Galactomyces
candidus) 		PF00135
(COesterase) 		4 TYR A 273
THR A 278
PRO A 263
ILE A 265
 None
 1.08A 5jhdE-1thgA:
undetectable
5jhdG-1thgA:
undetectable		 5jhdE-1thgA:
18.63
5jhdG-1thgA:
10.33
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.
1tr1 BETA-GLUCOSIDASE A

(Paenibacillus
polymyxa) 		PF00232
(Glyco_hydro_1) 		4 THR A  14
THR A  16
ARG A 426
ILE A 417
 None
 1.11A 5jhdE-1tr1A:
undetectable
5jhdG-1tr1A:
undetectable		 5jhdE-1tr1A:
18.49
5jhdG-1tr1A:
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.
1v6u ENDO-1,4-BETA-D-XYLA
NASE

(Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10)
PF00652
(Ricin_B_lectin) 		4 TYR A 361
SER A 330
THR A 332
THR A 335
 None
 1.04A 5jhdE-1v6uA:
undetectable
5jhdG-1v6uA:
undetectable		 5jhdE-1v6uA:
22.43
5jhdG-1v6uA:
15.66
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.
1yb5 QUINONE
OXIDOREDUCTASE

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 THR A 113
THR A  95
PRO A  33
ILE A  99
 CL  A 818 (-3.2A)
None
None
CL  A 818 ( 4.9A)
 1.12A 5jhdE-1yb5A:
undetectable
5jhdG-1yb5A:
undetectable		 5jhdE-1yb5A:
24.72
5jhdG-1yb5A:
13.60
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.
1ywg GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Plasmodium
falciparum) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 TYR O 323
SER O 152
THR O 154
PRO O 125
 NAD  O 401 (-3.7A)
None
None
None
 1.00A 5jhdE-1ywgO:
0.8
5jhdG-1ywgO:
undetectable		 5jhdE-1ywgO:
22.09
5jhdG-1ywgO:
14.76
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.
2amh SEPTUM FORMATION
PROTEIN MAF
HOMOLOGUE, PUTATIVE

(Trypanosoma
brucei) 		PF02545
(Maf) 		4 TYR A 126
THR A  87
THR A  16
ILE A  60
 None
None
SO4  A 401 (-3.8A)
MN  A2001 ( 4.9A)
 1.00A 5jhdE-2amhA:
undetectable
5jhdG-2amhA:
undetectable		 5jhdE-2amhA:
23.69
5jhdG-2amhA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dgd 223AA LONG
HYPOTHETICAL
ARYLMALONATE
DECARBOXYLASE

(Sulfurisphaera
tokodaii) 		no annotation 4 TYR A 176
SER A 201
THR A 184
PRO A  95
 None
 0.88A 5jhdE-2dgdA:
undetectable
5jhdG-2dgdA:
undetectable		 5jhdE-2dgdA:
26.49
5jhdG-2dgdA:
17.86
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.
2g40 CONSERVED
HYPOTHETICAL PROTEIN

(Deinococcus
radiodurans) 		PF02589
(LUD_dom) 		4 TYR A  55
SER A 184
THR A 127
ILE A 131
 None
 0.83A 5jhdE-2g40A:
undetectable
5jhdG-2g40A:
undetectable		 5jhdE-2g40A:
22.34
5jhdG-2g40A:
17.27
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.
2hk3 DIPHOSPHOMEVALONATE
DECARBOXYLASE

(Staphylococcus
aureus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 SER A  94
THR A  45
THR A  43
ILE A  73
 None
 1.08A 5jhdE-2hk3A:
undetectable
5jhdG-2hk3A:
undetectable		 5jhdE-2hk3A:
20.83
5jhdG-2hk3A:
15.09
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS)
PF02332
(Phenol_Hydrox) 		4 TYR B  86
THR A 128
PRO A  56
ILE A  53
 None
 1.13A 5jhdE-2incB:
undetectable
5jhdG-2incB:
undetectable		 5jhdE-2incB:
21.86
5jhdG-2incB:
14.33
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.
2j04 YDR362CP

(Saccharomyces
cerevisiae) 		no annotation 4 SER B 572
THR B 554
ARG B 601
ILE B 578
 None
 1.07A 5jhdE-2j04B:
undetectable
5jhdG-2j04B:
undetectable		 5jhdE-2j04B:
16.76
5jhdG-2j04B:
11.60
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.
2km8 MRNA
3'-END-PROCESSING
PROTEIN RNA15

(Saccharomyces
cerevisiae) 		PF00076
(RRM_1) 		4 SER B  80
ARG B  75
PRO B  51
ILE B  53
 None
 1.00A 5jhdE-2km8B:
undetectable
5jhdG-2km8B:
undetectable		 5jhdE-2km8B:
17.31
5jhdG-2km8B:
22.94
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.
2loz TENSIN-LIKE C1
DOMAIN-CONTAINING
PHOSPHATASE

(Homo sapiens) 		PF08416
(PTB) 		4 THR A1282
ARG A1353
PRO A1350
ILE A1365
 None
 1.14A 5jhdE-2lozA:
undetectable
5jhdG-2lozA:
undetectable		 5jhdE-2lozA:
19.50
5jhdG-2lozA:
17.93
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.
2q0o PROBABLE
TRANSCRIPTIONAL
ACTIVATOR PROTEIN
TRAR

(Sinorhizobium
fredii) 		PF00196
(GerE)
PF03472
(Autoind_bind) 		4 SER A 109
ARG A  38
PRO A 135
ILE A 112
 None
None
None
LAE  A1001 (-4.2A)
 0.93A 5jhdE-2q0oA:
undetectable
5jhdG-2q0oA:
undetectable		 5jhdE-2q0oA:
23.70
5jhdG-2q0oA:
19.57
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN

(Azospirillum
brasilense) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 SER A 641
THR A 640
THR A 602
ARG A 559
ILE A 605
 None
 1.40A 5jhdE-2vdcA:
undetectable
5jhdG-2vdcA:
undetectable		 5jhdE-2vdcA:
10.50
5jhdG-2vdcA:
5.54
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.
2vsm HEMAGGLUTININ-NEURAM
INIDASE

(Nipah
henipavirus) 		PF00423
(HN) 		4 SER A 576
THR A 563
THR A 561
PRO A 200
 None
 1.10A 5jhdE-2vsmA:
undetectable
5jhdG-2vsmA:
undetectable		 5jhdE-2vsmA:
24.06
5jhdG-2vsmA:
13.29
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.
2xdd TOXN

(Pectobacterium
atrosepticum) 		PF13958
(ToxN_toxin) 		4 TYR A  29
SER A  24
PRO A  50
ILE A   6
 None
 1.01A 5jhdE-2xddA:
undetectable
5jhdG-2xddA:
undetectable		 5jhdE-2xddA:
24.00
5jhdG-2xddA:
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.
2yew E2 ENVELOPE
GLYCOPROTEIN

(Barmah Forest
virus) 		PF00943
(Alpha_E2_glycop) 		4 TYR C 227
THR C 193
THR C 208
PRO C 169
 None
 1.07A 5jhdE-2yewC:
undetectable
5jhdG-2yewC:
1.0		 5jhdE-2yewC:
18.91
5jhdG-2yewC:
15.00
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.
2z5x AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Homo sapiens) 		PF01593
(Amino_oxidase) 		4 SER A 442
THR A 408
PRO A 143
ILE A 423
 None
 1.08A 5jhdE-2z5xA:
undetectable
5jhdG-2z5xA:
undetectable		 5jhdE-2z5xA:
19.96
5jhdG-2z5xA:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zns GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 1

(Homo sapiens) 		PF10613
(Lig_chan-Glu_bd) 		4 SER A 674
THR A 503
THR A 505
ILE A 523
 GLU  A 301 (-3.2A)
GLU  A 301 (-3.9A)
None
None
 0.92A 5jhdE-2znsA:
undetectable
5jhdG-2znsA:
undetectable		 5jhdE-2znsA:
20.30
5jhdG-2znsA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3alq TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER
1B

(Homo sapiens) 		PF00020
(TNFR_c6) 		4 SER R 152
THR R 150
PRO R 130
ILE R 156
 None
 1.12A 5jhdE-3alqR:
undetectable
5jhdG-3alqR:
undetectable		 5jhdE-3alqR:
19.26
5jhdG-3alqR:
16.18
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.
3b9n ALKANE MONOOXYGENASE

(Geobacillus
thermodenitrificans) 		PF00296
(Bac_luciferase) 		4 TYR A 205
LYS A 204
THR A 108
ILE A 151
 None
 1.06A 5jhdE-3b9nA:
undetectable
5jhdG-3b9nA:
undetectable		 5jhdE-3b9nA:
20.98
5jhdG-3b9nA:
12.53
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.
3bg0 NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF12110
(Nup96) 		4 SER B 327
ARG B 331
PRO B 330
ILE B 332
 None
 0.84A 5jhdE-3bg0B:
undetectable
5jhdG-3bg0B:
undetectable		 5jhdE-3bg0B:
19.78
5jhdG-3bg0B:
11.19
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.
3cps GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE

(Cryptosporidium
parvum) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 TYR A 338
SER A 167
THR A 169
PRO A 139
 NAD  A 401 (-3.7A)
None
None
None
 0.96A 5jhdE-3cpsA:
undetectable
5jhdG-3cpsA:
undetectable		 5jhdE-3cpsA:
23.04
5jhdG-3cpsA:
12.71
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.
3dh4 SODIUM/GLUCOSE
COTRANSPORTER

(Vibrio
parahaemolyticus) 		PF00474
(SSF) 		4 SER A 463
THR A 490
THR A 486
ILE A 438
 None
 0.66A 5jhdE-3dh4A:
undetectable
5jhdG-3dh4A:
undetectable		 5jhdE-3dh4A:
20.49
5jhdG-3dh4A:
10.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ew7 LMO0794 PROTEIN

(Listeria
monocytogenes) 		PF13460
(NAD_binding_10) 		4 TYR A 190
SER A 154
THR A 209
PRO A 129
 None
 1.00A 5jhdE-3ew7A:
undetectable
5jhdG-3ew7A:
undetectable		 5jhdE-3ew7A:
21.37
5jhdG-3ew7A:
19.00
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.
3fsn RETINAL PIGMENT
EPITHELIUM-SPECIFIC
65 KDA PROTEIN

(Bos taurus) 		PF03055
(RPE65) 		4 TYR A 190
LYS A 208
THR A 246
ARG A 296
 None
None
None
PG4  A 535 ( 3.3A)
 1.09A 5jhdE-3fsnA:
undetectable
5jhdG-3fsnA:
undetectable		 5jhdE-3fsnA:
19.11
5jhdG-3fsnA:
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.
3h6t GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 SER A 142
THR A  91
THR A  93
ILE A 111
 GLU  A 264 (-3.2A)
GLU  A 264 (-4.2A)
None
None
 1.04A 5jhdE-3h6tA:
undetectable
5jhdG-3h6tA:
undetectable		 5jhdE-3h6tA:
21.55
5jhdG-3h6tA:
16.35
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.
3hs0 COBRA VENOM FACTOR
COBRA VENOM FACTOR

(Naja kaouthia;
Naja kaouthia) 		PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF01759
(NTR)
PF07677
(A2M_recep) 		4 TYR A 164
THR C1280
PRO A 146
ILE A 149
 None
 1.07A 5jhdE-3hs0A:
5.4
5jhdG-3hs0A:
4.8		 5jhdE-3hs0A:
16.69
5jhdG-3hs0A:
9.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k4i UNCHARACTERIZED
PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF03737
(RraA-like) 		4 LYS A 152
SER A  90
PRO A 157
ILE A 165
 None
 1.14A 5jhdE-3k4iA:
undetectable
5jhdG-3k4iA:
undetectable		 5jhdE-3k4iA:
23.05
5jhdG-3k4iA:
15.57
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.
3kiz PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
CYCLO-LIGASE

(Cytophaga
hutchinsonii) 		PF02769
(AIRS_C) 		4 TYR A 239
THR A 210
THR A  60
PRO A 231
 None
 1.13A 5jhdE-3kizA:
undetectable
5jhdG-3kizA:
undetectable		 5jhdE-3kizA:
23.47
5jhdG-3kizA:
12.72
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.
3mq0 TRANSCRIPTIONAL
REPRESSOR OF THE
BLCABC OPERON

(Agrobacterium
tumefaciens) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		4 SER A 239
THR A 120
THR A 122
ARG A 215
 None
 1.00A 5jhdE-3mq0A:
undetectable
5jhdG-3mq0A:
undetectable		 5jhdE-3mq0A:
20.83
5jhdG-3mq0A:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n5a SYNAPTOTAGMIN-7

(Mus musculus) 		PF00168
(C2) 		4 LYS A 385
SER A 373
THR A 350
PRO A 378
 None
 1.06A 5jhdE-3n5aA:
4.0
5jhdG-3n5aA:
4.6		 5jhdE-3n5aA:
19.34
5jhdG-3n5aA:
24.80
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.
3nvn PLEXIN-C1

(Homo sapiens) 		PF01437
(PSI) 		4 SER B 311
THR B 325
ARG B 100
PRO B 101
 None
 1.04A 5jhdE-3nvnB:
undetectable
5jhdG-3nvnB:
undetectable		 5jhdE-3nvnB:
18.26
5jhdG-3nvnB:
11.76
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.
3ogf DE NOVO DESIGNED
DIMERIC TREFOIL-FOLD
SUB-DOMAIN WHICH
FORMS HOMO-TRIMER
ASSEMBLY

(synthetic
construct) 		PF00167
(FGF) 		4 SER A  58
THR A  59
ARG A  24
ILE A  42
 None
 1.12A 5jhdE-3ogfA:
undetectable
5jhdG-3ogfA:
undetectable		 5jhdE-3ogfA:
17.50
5jhdG-3ogfA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oql TENA HOMOLOG

(Pseudomonas
syringae group
genomosp. 3) 		PF14518
(Haem_oxygenas_2) 		4 TYR A 233
LYS A  32
THR A 154
ILE A 209
 None
 1.07A 5jhdE-3oqlA:
undetectable
5jhdG-3oqlA:
undetectable		 5jhdE-3oqlA:
20.36
5jhdG-3oqlA:
17.62
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.
3qzy BACULOVIRUS
SULFHYDRYL OXIDASE
AC92

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF05214
(Baculo_p33) 		4 SER A  29
THR A  35
THR A  32
PRO A  74
 None
 1.02A 5jhdE-3qzyA:
undetectable
5jhdG-3qzyA:
undetectable		 5jhdE-3qzyA:
24.39
5jhdG-3qzyA:
19.03
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.
3ri6 O-ACETYLHOMOSERINE
SULFHYDRYLASE

(Wolinella
succinogenes) 		PF01053
(Cys_Met_Meta_PP) 		4 TYR A 187
THR A 274
ARG A 281
ILE A 392
 None
 1.14A 5jhdE-3ri6A:
undetectable
5jhdG-3ri6A:
undetectable		 5jhdE-3ri6A:
19.53
5jhdG-3ri6A:
12.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ros NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Lactobacillus
acidophilus) 		PF00171
(Aldedh) 		4 SER A 390
THR A 412
THR A 409
ILE A 237
 None
 0.97A 5jhdE-3rosA:
undetectable
5jhdG-3rosA:
undetectable		 5jhdE-3rosA:
18.48
5jhdG-3rosA:
11.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sqw ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 LYS A  95
THR A 156
PRO A 336
ILE A 461
 None
ANP  A 800 (-4.7A)
None
None
 1.09A 5jhdE-3sqwA:
undetectable
5jhdG-3sqwA:
undetectable		 5jhdE-3sqwA:
17.87
5jhdG-3sqwA:
12.25
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.
3sth GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Toxoplasma
gondii) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 TYR A 323
SER A 151
THR A 153
PRO A 124
 NAD  A 380 (-3.6A)
None
None
None
 0.95A 5jhdE-3sthA:
undetectable
5jhdG-3sthA:
undetectable		 5jhdE-3sthA:
20.27
5jhdG-3sthA:
13.45
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.
3uyr ANTIBODY FAB HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR H 149
SER H 153
THR H 112
PRO H 171
 None
 1.04A 5jhdE-3uyrH:
18.4
5jhdG-3uyrH:
5.5		 5jhdE-3uyrH:
28.19
5jhdG-3uyrH:
14.80
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.
3von UBIQUITIN
THIOESTERASE OTUB1

(Homo sapiens) 		PF10275
(Peptidase_C65) 		4 TYR A  79
LYS A  78
PRO A 255
ILE A 231
 None
 0.99A 5jhdE-3vonA:
undetectable
5jhdG-3vonA:
undetectable		 5jhdE-3vonA:
22.61
5jhdG-3vonA:
19.11
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.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 4 THR A 172
ARG A 123
PRO A 121
ILE A 181
 None
 1.14A 5jhdE-3w36A:
undetectable
5jhdG-3w36A:
undetectable		 5jhdE-3w36A:
17.60
5jhdG-3w36A:
10.06
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.
4aqq L2 PROTEIN III
(PENTON BASE)

(Human
mastadenovirus
B) 		PF01686
(Adeno_Penton_B) 		4 SER A 413
THR A 515
THR A 517
PRO A 421
 None
 1.01A 5jhdE-4aqqA:
undetectable
5jhdG-4aqqA:
undetectable		 5jhdE-4aqqA:
19.05
5jhdG-4aqqA:
11.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4asi ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF01039
(Carboxyl_trans) 		4 THR A1632
THR A1858
PRO A1639
ILE A1635
 None
 1.14A 5jhdE-4asiA:
undetectable
5jhdG-4asiA:
undetectable		 5jhdE-4asiA:
16.34
5jhdG-4asiA:
8.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF00374
(NiFeSe_Hases) 		4 TYR A  34
SER A  36
THR A 385
PRO A   9
 None
 1.11A 5jhdE-4ci0A:
undetectable
5jhdG-4ci0A:
undetectable		 5jhdE-4ci0A:
20.05
5jhdG-4ci0A:
16.42
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.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		4 TYR A 182
SER A 201
THR A 171
PRO A   8
 None
PI  A 301 ( 4.7A)
None
None
 1.06A 5jhdE-4evzA:
undetectable
5jhdG-4evzA:
undetectable		 5jhdE-4evzA:
22.34
5jhdG-4evzA:
14.46
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.
4fxs INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Vibrio cholerae) 		PF00478
(IMPDH)
PF00571
(CBS) 		4 SER A 449
THR A 447
ARG A 456
ILE A 353
 None
 1.06A 5jhdE-4fxsA:
undetectable
5jhdG-4fxsA:
undetectable		 5jhdE-4fxsA:
16.53
5jhdG-4fxsA:
10.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h1l ANI2.3 TCR B CHAIN

(Escherichia
coli) 		PF07686
(V-set) 		5 TYR H  45
LYS H  55
SER H  63
THR H  75
THR H  77
 None
 0.58A 5jhdE-4h1lH:
20.5
5jhdG-4h1lH:
5.7		 5jhdE-4h1lH:
91.07
5jhdG-4h1lH:
22.41
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.
4hvt POST-PROLINE
CLEAVING ENZYME

(Rickettsia
typhi) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		4 TYR A 464
LYS A 452
THR A 480
ILE A 550
 None
 1.00A 5jhdE-4hvtA:
undetectable
5jhdG-4hvtA:
undetectable		 5jhdE-4hvtA:
16.71
5jhdG-4hvtA:
12.10
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.
4jza UNCHARACTERIZED
PROTEIN

(Legionella
longbeachae) 		no annotation 4 SER A 549
THR A 416
PRO A 348
ILE A 378
 None
 1.02A 5jhdE-4jzaA:
undetectable
5jhdG-4jzaA:
undetectable		 5jhdE-4jzaA:
16.03
5jhdG-4jzaA:
7.53
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.
4lsm GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC

(Trypanosoma
cruzi) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 TYR A 324
SER A 155
THR A 157
PRO A 129
 NAD  A 401 (-3.6A)
None
None
None
 0.96A 5jhdE-4lsmA:
undetectable
5jhdG-4lsmA:
undetectable		 5jhdE-4lsmA:
20.22
5jhdG-4lsmA:
14.12
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.
4mdp BETA-GLUCOSIDASE

(Humicola grisea) 		PF00232
(Glyco_hydro_1) 		4 SER A 381
THR A 441
ARG A 351
PRO A 352
 None
 1.04A 5jhdE-4mdpA:
undetectable
5jhdG-4mdpA:
undetectable		 5jhdE-4mdpA:
18.44
5jhdG-4mdpA:
12.18
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.
4rgq GLYCEROL-1-PHOSPHATE
DEHYDROGENASE

(Methanocaldococcus
jannaschii) 		PF13685
(Fe-ADH_2) 		4 TYR A 170
LYS A 160
SER A 171
ILE A 214
 None
 0.87A 5jhdE-4rgqA:
undetectable
5jhdG-4rgqA:
undetectable		 5jhdE-4rgqA:
20.11
5jhdG-4rgqA:
14.49
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 SER A2870
THR A2868
ARG A3341
ILE A3386
 None
 0.75A 5jhdE-4rh7A:
undetectable
5jhdG-4rh7A:
undetectable		 5jhdE-4rh7A:
5.89
5jhdG-4rh7A:
2.46
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.
4wwj TENA/THI-4 FAMILY
PROTEIN

(Pseudomonas
protegens) 		PF14518
(Haem_oxygenas_2) 		4 TYR A 233
LYS A  32
THR A 154
ILE A 209
 None
 1.10A 5jhdE-4wwjA:
undetectable
5jhdG-4wwjA:
undetectable		 5jhdE-4wwjA:
22.57
5jhdG-4wwjA:
16.67
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.
4xkq NICKEL ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Staphylococcus
aureus) 		PF00496
(SBP_bac_5) 		4 TYR A 387
THR A 373
PRO A 290
ILE A 287
 None
None
GOL  A 506 (-4.2A)
None
 1.07A 5jhdE-4xkqA:
undetectable
5jhdG-4xkqA:
undetectable		 5jhdE-4xkqA:
19.62
5jhdG-4xkqA:
11.78
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.
4xmm NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF12110
(Nup96) 		4 SER B 328
ARG B 332
PRO B 331
ILE B 333
 None
 1.09A 5jhdE-4xmmB:
undetectable
5jhdG-4xmmB:
undetectable		 5jhdE-4xmmB:
17.00
5jhdG-4xmmB:
8.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y1k OUTER MEMBRANE
PROTEIN OPRM

(Pseudomonas
aeruginosa) 		PF02321
(OEP) 		4 SER A 104
THR A 106
ARG A  98
ILE A 111
 None
 0.91A 5jhdE-4y1kA:
undetectable
5jhdG-4y1kA:
undetectable		 5jhdE-4y1kA:
21.33
5jhdG-4y1kA:
12.15
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.
4y4v CONSERVED
HYPOTHETICAL
SECRETED PROTEIN

(Helicobacter
pylori) 		PF03734
(YkuD) 		4 TYR A 280
THR A 200
PRO A 143
ILE A 157
 None
None
None
CSO  A 176 ( 4.7A)
 0.98A 5jhdE-4y4vA:
undetectable
5jhdG-4y4vA:
undetectable		 5jhdE-4y4vA:
21.10
5jhdG-4y4vA:
14.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zxz LEVOGLUCOSAN KINASE

(Lipomyces
starkeyi) 		PF03702
(AnmK) 		4 SER A 397
THR A 148
THR A 150
ILE A 139
 None
 1.07A 5jhdE-4zxzA:
undetectable
5jhdG-4zxzA:
undetectable		 5jhdE-4zxzA:
19.38
5jhdG-4zxzA:
13.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dt5 BETA-GLUCOSIDASE

(Exiguobacterium
antarcticum) 		PF00232
(Glyco_hydro_1) 		4 THR A  11
THR A  13
ARG A 424
ILE A 415
 None
 1.05A 5jhdE-5dt5A:
undetectable
5jhdG-5dt5A:
undetectable		 5jhdE-5dt5A:
18.74
5jhdG-5dt5A:
12.16
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.
5e5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Mus musculus) 		PF00194
(Carb_anhydrase) 		4 TYR A 179
LYS A 144
SER A 186
THR A 189
 None
 1.08A 5jhdE-5e5uA:
undetectable
5jhdG-5e5uA:
undetectable		 5jhdE-5e5uA:
21.90
5jhdG-5e5uA:
15.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5euo PF6 TCR BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 TYR F  45
LYS F  55
SER F  63
THR F  75
THR F  77
 None
 0.61A 5jhdE-5euoF:
31.0
5jhdG-5euoF:
11.1		 5jhdE-5euoF:
95.83
5jhdG-5euoF:
17.92
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.
5hdq FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR H 145
SER H 149
THR H 108
PRO H 167
 None
 1.09A 5jhdE-5hdqH:
18.3
5jhdG-5hdqH:
11.6		 5jhdE-5hdqH:
29.27
5jhdG-5hdqH:
15.18
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.
5hvf CARBOXYPEPTIDASE B2

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 THR A 367
THR A 369
PRO A 381
ILE A 329
 None
 1.12A 5jhdE-5hvfA:
undetectable
5jhdG-5hvfA:
undetectable		 5jhdE-5hvfA:
21.10
5jhdG-5hvfA:
14.17
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.
5hw3 BETA-LACTAMASE

(Burkholderia
vietnamiensis) 		PF13354
(Beta-lactamase2) 		4 SER A 106
THR A 109
PRO A 168
ILE A 137
 None
 1.05A 5jhdE-5hw3A:
undetectable
5jhdG-5hw3A:
undetectable		 5jhdE-5hw3A:
22.49
5jhdG-5hw3A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikb GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4,GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		4 SER A 141
THR A  90
THR A  92
ILE A 110
 KAI  A 301 ( 3.3A)
KAI  A 301 (-3.9A)
GOL  A 302 (-3.0A)
None
 1.02A 5jhdE-5ikbA:
undetectable
5jhdG-5ikbA:
undetectable		 5jhdE-5ikbA:
21.74
5jhdG-5ikbA:
15.06
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.
5jbk BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		4 SER A 371
THR A 431
ARG A 341
PRO A 342
 None
 1.06A 5jhdE-5jbkA:
undetectable
5jhdG-5jbkA:
undetectable		 5jhdE-5jbkA:
19.48
5jhdG-5jbkA:
15.25
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.
5jx3 URACIL-DNA
GLYCOSYLASE

(Vaccinia virus) 		no annotation 4 TYR A  15
SER A   3
THR A  12
THR A   5
 None
 1.11A 5jhdE-5jx3A:
undetectable
5jhdG-5jx3A:
undetectable		 5jhdE-5jx3A:
22.61
5jhdG-5jx3A:
18.13
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.
5koj NITROGENASE PROTEIN
ALPHA CHAIN

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro) 		4 LYS A 162
SER A 124
THR A 120
ILE A 117
 None
 1.11A 5jhdE-5kojA:
undetectable
5jhdG-5kojA:
undetectable		 5jhdE-5kojA:
17.80
5jhdG-5kojA:
12.73
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.
5kuf GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
2

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 SER A 658
THR A 487
THR A 489
ILE A 507
 SYM  A 901 (-3.4A)
SYM  A 901 (-3.7A)
None
None
 1.08A 5jhdE-5kufA:
undetectable
5jhdG-5kufA:
undetectable		 5jhdE-5kufA:
13.97
5jhdG-5kufA:
8.28
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.
5kvm ADHESION G-PROTEIN
COUPLED RECEPTOR G1

(Mus musculus) 		PF01825
(GPS) 		4 SER A  95
THR A  98
ARG A  29
PRO A  28
 None
 1.02A 5jhdE-5kvmA:
undetectable
5jhdG-5kvmA:
undetectable		 5jhdE-5kvmA:
23.33
5jhdG-5kvmA:
16.47
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		4 SER A 584
THR A 565
THR A 659
ILE A 594
 None
 0.91A 5jhdE-5l46A:
undetectable
5jhdG-5l46A:
undetectable		 5jhdE-5l46A:
14.22
5jhdG-5l46A:
7.61
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 4 TYR A 470
THR A 529
ARG A 524
ILE A 517
 None
 0.94A 5jhdE-5lewA:
undetectable
5jhdG-5lewA:
undetectable		 5jhdE-5lewA:
12.75
5jhdG-5lewA:
7.45
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.
5mek CYTOSOLIC
SULFOTRANSFERASE 18

(Arabidopsis
thaliana) 		PF00685
(Sulfotransfer_1) 		4 SER A  90
THR A  96
THR A  94
PRO A 157
 A3P  A 401 ( 4.9A)
A3P  A 401 (-3.5A)
None
None
 0.92A 5jhdE-5mekA:
undetectable
5jhdG-5mekA:
undetectable		 5jhdE-5mekA:
17.96
5jhdG-5mekA:
16.15
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.
5o6v ENVELOPE PROTEIN

(Tick-borne
encephalitis
virus) 		no annotation 4 SER A  40
THR A  34
THR A  32
PRO A 362
 None
 1.13A 5jhdE-5o6vA:
4.3
5jhdG-5o6vA:
4.1		 5jhdE-5o6vA:
undetectable
5jhdG-5o6vA:
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.
5ol2 ACYL-COA
DEHYDROGENASE

(Clostridioides
difficile) 		no annotation 4 TYR C 165
LYS C 187
THR C 157
ILE C  85
 None
None
FAD  C 401 (-3.7A)
None
 1.02A 5jhdE-5ol2C:
undetectable
5jhdG-5ol2C:
undetectable		 5jhdE-5ol2C:
20.73
5jhdG-5ol2C:
13.78
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.
5u22 N2152

(Neocallimastix
frontalis) 		PF01229
(Glyco_hydro_39) 		4 SER A 342
THR A 321
ARG A 425
ILE A 353
 None
 1.12A 5jhdE-5u22A:
undetectable
5jhdG-5u22A:
undetectable		 5jhdE-5u22A:
19.43
5jhdG-5u22A:
12.38
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.
5u30 CRISPR-ASSOCIATED
ENDONUCLEASE C2C1

(Alicyclobacillus
acidoterrestris) 		no annotation 4 SER A1082
THR A 905
ARG A1103
ILE A1085
 None
 1.02A 5jhdE-5u30A:
undetectable
5jhdG-5u30A:
undetectable		 5jhdE-5u30A:
12.08
5jhdG-5u30A:
6.73
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.
5uz4 SMALL RIBOSOMAL
SUBUNIT BIOGENESIS
GTPASE RSGA

(Escherichia
coli) 		PF03193
(RsgA_GTPase) 		4 SER Z 105
THR Z 104
ARG Z 208
ILE Z 209
 None
 1.09A 5jhdE-5uz4Z:
undetectable
5jhdG-5uz4Z:
undetectable		 5jhdE-5uz4Z:
20.00
5jhdG-5uz4Z:
14.20
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.
5x5h CYSTATHIONINE
BETA-LYASES/CYSTATHI
ONINE
GAMMA-SYNTHASES

(Corynebacterium
glutamicum) 		PF01053
(Cys_Met_Meta_PP) 		4 TYR A 186
THR A 253
ARG A 260
ILE A 369
 None
 1.12A 5jhdE-5x5hA:
undetectable
5jhdG-5x5hA:
undetectable		 5jhdE-5x5hA:
20.41
5jhdG-5x5hA:
13.26
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.
5xfh SALT STRESS-INDUCED
PROTEIN

(Oryza sativa) 		no annotation 4 SER A  33
THR A  63
THR A  65
PRO A 110
 None
 1.03A 5jhdE-5xfhA:
undetectable
5jhdG-5xfhA:
undetectable		 5jhdE-5xfhA:
23.17
5jhdG-5xfhA:
20.95
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.
6beg SCAFFOLD PROTEIN D13

(Vaccinia virus) 		no annotation 4 SER A 256
THR A 476
THR A 474
PRO A 232
 None
 0.85A 5jhdE-6begA:
undetectable
5jhdG-6begA:
undetectable		 5jhdE-6begA:
undetectable
5jhdG-6begA:
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.
6enz ACIDIC AMINO ACID
DECARBOXYLASE GADL1

(Mus musculus) 		no annotation 4 TYR A 125
SER A 366
ARG A 368
PRO A 369
 None
 1.12A 5jhdE-6enzA:
undetectable
5jhdG-6enzA:
undetectable		 5jhdE-6enzA:
undetectable
5jhdG-6enzA:
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.
6f42 DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC1

(Saccharomyces
cerevisiae) 		no annotation 4 TYR A 685
THR A 680
ARG A 655
ILE A 654
 None
 0.99A 5jhdE-6f42A:
undetectable
5jhdG-6f42A:
undetectable		 5jhdE-6f42A:
undetectable
5jhdG-6f42A:
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.
6fdg 4-HYDROXYBENZOYL-COA
THIOESTERASE

(Staphylococcus
aureus) 		no annotation 4 SER A   4
THR A   6
ARG A  34
ILE A  38
 None
 1.11A 5jhdE-6fdgA:
undetectable
5jhdG-6fdgA:
undetectable		 5jhdE-6fdgA:
undetectable
5jhdG-6fdgA:
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.
6fwf NITRIC-OXIDE
REDUCTASE

(Neisseria
meningitidis) 		no annotation 4 THR A 210
THR A 212
PRO A 219
ILE A 221
 None
 1.13A 5jhdE-6fwfA:
undetectable
5jhdG-6fwfA:
undetectable		 5jhdE-6fwfA:
undetectable
5jhdG-6fwfA:
undetectable