SIMILAR PATTERNS OF AMINO ACIDS FOR 2HDN_H_TACH4888_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dot DUCK OVOTRANSFERRIN

(Anas
platyrhynchos) 		PF00405
(Transferrin) 		4 SER A 159
VAL A 161
LEU A 331
SER A 114
 None
 0.88A 2hdnF-1dotA:
undetectable
2hdnG-1dotA:
0.0
2hdnH-1dotA:
undetectable		 2hdnF-1dotA:
19.74
2hdnG-1dotA:
5.06
2hdnH-1dotA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		4 VAL A  43
LEU A 597
SER A 187
ASP A 405
 None
None
CA  A2000 ( 4.7A)
CA  A2000 (-3.6A)
 0.98A 2hdnF-1fbwA:
undetectable
2hdnG-1fbwA:
0.0
2hdnH-1fbwA:
undetectable		 2hdnF-1fbwA:
20.13
2hdnG-1fbwA:
4.95
2hdnH-1fbwA:
20.13
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.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		4 SER A 156
VAL A 158
LEU A 330
SER A 116
 None
 0.97A 2hdnF-1h76A:
undetectable
2hdnG-1h76A:
0.0
2hdnH-1h76A:
0.0		 2hdnF-1h76A:
19.15
2hdnG-1h76A:
5.63
2hdnH-1h76A:
19.15
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.
1i8k EPIDERMAL GROWTH
FACTOR RECEPTOR
ANTIBODY MR1SCFV
HEAVY CHAIN
EPIDERMAL GROWTH
FACTOR RECEPTOR
ANTIBODY MR1SCFV
LIGHT CHAIN

(Mus musculus) 		PF07686
(V-set) 		4 SER B 335
VAL B 337
LEU A   4
SER B 350
 None
 0.98A 2hdnF-1i8kB:
undetectable
2hdnG-1i8kB:
0.0
2hdnH-1i8kB:
undetectable		 2hdnF-1i8kB:
15.52
2hdnG-1i8kB:
15.32
2hdnH-1i8kB:
15.52
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.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		4 SER A 157
VAL A 159
LEU A 326
SER A 117
 None
 0.89A 2hdnF-1jnfA:
undetectable
2hdnG-1jnfA:
0.0
2hdnH-1jnfA:
undetectable		 2hdnF-1jnfA:
19.36
2hdnG-1jnfA:
4.55
2hdnH-1jnfA:
19.36
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.
1m66 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Leishmania
mexicana) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		4 SER A 149
LEU A  13
SER A 172
ASP A 174
 None
 0.98A 2hdnF-1m66A:
undetectable
2hdnG-1m66A:
0.0
2hdnH-1m66A:
2.4		 2hdnF-1m66A:
20.57
2hdnG-1m66A:
10.09
2hdnH-1m66A:
20.57
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.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		4 SER A 156
VAL A 158
LEU A 331
SER A 114
 None
 1.01A 2hdnF-1n76A:
undetectable
2hdnG-1n76A:
0.0
2hdnH-1n76A:
undetectable		 2hdnF-1n76A:
19.19
2hdnG-1n76A:
5.60
2hdnH-1n76A:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1obh LEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2)
PF14795
(Leucyl-specific) 		4 SER A 386
VAL A 384
LEU A 373
ASP A 251
 None
 1.04A 2hdnF-1obhA:
2.1
2hdnG-1obhA:
0.4
2hdnH-1obhA:
undetectable		 2hdnF-1obhA:
17.73
2hdnG-1obhA:
9.09
2hdnH-1obhA:
17.73
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.
1pp0 VOLVATOXIN A2

(Volvariella
volvacea) 		PF01338
(Bac_thur_toxin) 		4 SER A 152
VAL A 154
SER A 139
ASP A  11
 None
 0.51A 2hdnF-1pp0A:
undetectable
2hdnG-1pp0A:
undetectable
2hdnH-1pp0A:
undetectable		 2hdnF-1pp0A:
19.40
2hdnG-1pp0A:
13.16
2hdnH-1pp0A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qvr CLPB PROTEIN

(Thermus
thermophilus) 		PF00004
(AAA)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		4 VAL A 258
LEU A 186
THR A 161
ASP A 159
 None
 1.05A 2hdnF-1qvrA:
undetectable
2hdnG-1qvrA:
undetectable
2hdnH-1qvrA:
undetectable		 2hdnF-1qvrA:
18.17
2hdnG-1qvrA:
3.91
2hdnH-1qvrA:
18.17
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.
1r1a HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP1)
HUMAN RHINOVIRUS 1A
COAT PROTEIN
(SUBUNIT VP3)

(Rhinovirus A) 		PF00073
(Rhv) 		5 SER 3 164
VAL 3 166
THR 1  42
SER 3 116
ASP 3  50
 None
 1.16A 2hdnF-1r1a3:
undetectable
2hdnG-1r1a3:
undetectable
2hdnH-1r1a3:
undetectable		 2hdnF-1r1a3:
22.06
2hdnG-1r1a3:
13.33
2hdnH-1r1a3:
22.06
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.
1rrh SEED LIPOXYGENASE-3

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 SER A 483
VAL A 485
LEU A 380
SER A 470
 None
 0.90A 2hdnF-1rrhA:
undetectable
2hdnG-1rrhA:
undetectable
2hdnH-1rrhA:
undetectable		 2hdnF-1rrhA:
17.46
2hdnG-1rrhA:
3.83
2hdnH-1rrhA:
17.46
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.
1vcn CTP SYNTHETASE

(Thermus
thermophilus) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		4 VAL A 374
LEU A 483
THR A 420
ASP A 417
 None
 1.04A 2hdnF-1vcnA:
3.1
2hdnG-1vcnA:
undetectable
2hdnH-1vcnA:
3.6		 2hdnF-1vcnA:
22.22
2hdnG-1vcnA:
6.20
2hdnH-1vcnA:
22.22
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.
1x42 HYPOTHETICAL PROTEIN
PH0459

(Pyrococcus
horikoshii) 		PF13419
(HAD_2) 		4 VAL A 216
LEU A 112
THR A 195
ASP A 213
 None
 1.03A 2hdnF-1x42A:
undetectable
2hdnG-1x42A:
undetectable
2hdnH-1x42A:
undetectable		 2hdnF-1x42A:
21.39
2hdnG-1x42A:
11.17
2hdnH-1x42A:
21.39
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.
1yv9 HYDROLASE, HALOACID
DEHALOGENASE FAMILY

(Enterococcus
faecalis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		4 VAL A 248
LEU A  33
SER A 229
ASP A 208
 None
 1.04A 2hdnF-1yv9A:
undetectable
2hdnG-1yv9A:
undetectable
2hdnH-1yv9A:
undetectable		 2hdnF-1yv9A:
22.71
2hdnG-1yv9A:
15.97
2hdnH-1yv9A:
22.71
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.
2b7n PROBABLE
NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Helicobacter
pylori) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 SER A  44
VAL A  42
LEU A 121
SER A 100
 None
 1.00A 2hdnF-2b7nA:
2.6
2hdnG-2b7nA:
undetectable
2hdnH-2b7nA:
3.0		 2hdnF-2b7nA:
21.84
2hdnG-2b7nA:
13.37
2hdnH-2b7nA:
21.84
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.
2bbk METHYLAMINE
DEHYDROGENASE (HEAVY
SUBUNIT)

(Paracoccus
denitrificans) 		PF06433
(Me-amine-dh_H) 		4 LEU H  67
THR H 338
SER H 322
ASP H 321
 None
 0.95A 2hdnF-2bbkH:
undetectable
2hdnG-2bbkH:
undetectable
2hdnH-2bbkH:
undetectable		 2hdnF-2bbkH:
23.10
2hdnG-2bbkH:
8.93
2hdnH-2bbkH:
23.10
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.
2bkw ALANINE-GLYOXYLATE
AMINOTRANSFERASE 1

(Saccharomyces
cerevisiae) 		PF00266
(Aminotran_5) 		4 SER A  57
LEU A 275
SER A  59
PRO A  61
 None
 1.00A 2hdnF-2bkwA:
undetectable
2hdnG-2bkwA:
undetectable
2hdnH-2bkwA:
2.6		 2hdnF-2bkwA:
22.11
2hdnG-2bkwA:
7.59
2hdnH-2bkwA:
22.11
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.
2grm PRGX

(Enterococcus
faecalis) 		PF01381
(HTH_3) 		4 SER A 253
LEU A 198
THR A 247
ASP A 248
 None
 1.04A 2hdnF-2grmA:
undetectable
2hdnG-2grmA:
undetectable
2hdnH-2grmA:
undetectable		 2hdnF-2grmA:
19.61
2hdnG-2grmA:
12.02
2hdnH-2grmA:
19.61
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.
2inr DNA TOPOISOMERASE 4
SUBUNIT A

(Staphylococcus
aureus) 		PF00521
(DNA_topoisoIV) 		4 SER A  51
LEU A  38
THR A  66
SER A  52
 None
 1.01A 2hdnF-2inrA:
undetectable
2hdnG-2inrA:
undetectable
2hdnH-2inrA:
undetectable		 2hdnF-2inrA:
20.62
2hdnG-2inrA:
7.81
2hdnH-2inrA:
20.62
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.
2iuk SEED LIPOXYGENASE

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 SER A 490
VAL A 492
LEU A 386
SER A 477
 None
 1.00A 2hdnF-2iukA:
undetectable
2hdnG-2iukA:
undetectable
2hdnH-2iukA:
undetectable		 2hdnF-2iukA:
16.88
2hdnG-2iukA:
3.64
2hdnH-2iukA:
16.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o16 ACETOIN UTILIZATION
PROTEIN ACUB,
PUTATIVE

(Vibrio cholerae) 		PF00571
(CBS) 		4 LEU A  46
THR A  28
SER A 143
ASP A 144
 None
None
PO4  A   1 (-2.8A)
None
 1.01A 2hdnF-2o16A:
undetectable
2hdnG-2o16A:
undetectable
2hdnH-2o16A:
undetectable		 2hdnF-2o16A:
19.40
2hdnG-2o16A:
14.93
2hdnH-2o16A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oaa R.MVAI

(Kocuria varians) 		PF15515
(MvaI_BcnI) 		4 SER A 167
VAL A 165
LEU A 237
SER A 183
 None
 0.89A 2hdnF-2oaaA:
undetectable
2hdnG-2oaaA:
undetectable
2hdnH-2oaaA:
undetectable		 2hdnF-2oaaA:
21.57
2hdnG-2oaaA:
11.00
2hdnH-2oaaA:
21.57
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.
2qs8 XAA-PRO DIPEPTIDASE

(Alteromonas
macleodii) 		PF01979
(Amidohydro_1) 		4 SER A 105
VAL A 101
THR A 327
ASP A  67
 None
 0.96A 2hdnF-2qs8A:
2.5
2hdnG-2qs8A:
undetectable
2hdnH-2qs8A:
2.5		 2hdnF-2qs8A:
23.65
2hdnG-2qs8A:
9.97
2hdnH-2qs8A:
23.65
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.
2vrc TRIPHENYLMETHANE
REDUCTASE

(Citrobacter sp.
MY-5) 		PF05368
(NmrA) 		4 SER A 155
VAL A 221
LEU A 277
THR A 163
 None
 1.01A 2hdnF-2vrcA:
6.5
2hdnG-2vrcA:
undetectable
2hdnH-2vrcA:
6.5		 2hdnF-2vrcA:
22.73
2hdnG-2vrcA:
9.96
2hdnH-2vrcA:
22.73
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.
2wyo GLUTATHIONE
SYNTHETASE

(Trypanosoma
brucei) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		4 SER A 495
VAL A 497
THR A  43
SER A 531
 None
 0.74A 2hdnF-2wyoA:
undetectable
2hdnG-2wyoA:
undetectable
2hdnH-2wyoA:
undetectable		 2hdnF-2wyoA:
19.82
2hdnG-2wyoA:
4.86
2hdnH-2wyoA:
19.82
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.
2wyx BETA-LACTAMSE TOHO-1

(Escherichia
coli) 		PF13354
(Beta-lactamase2) 		4 VAL A 148
LEU A 127
THR A 189
ASP A 157
 None
 1.06A 2hdnF-2wyxA:
undetectable
2hdnG-2wyxA:
undetectable
2hdnH-2wyxA:
undetectable		 2hdnF-2wyxA:
20.65
2hdnG-2wyxA:
11.30
2hdnH-2wyxA:
20.65
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.
2xr1 CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
100 KD SUBUNIT

(Methanosarcina
mazei) 		PF07521
(RMMBL)
PF07650
(KH_2)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 VAL A 192
LEU A 586
SER A 195
ASP A 209
 None
 1.01A 2hdnF-2xr1A:
undetectable
2hdnG-2xr1A:
undetectable
2hdnH-2xr1A:
undetectable		 2hdnF-2xr1A:
20.68
2hdnG-2xr1A:
6.81
2hdnH-2xr1A:
20.68
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.
2ycb CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR

(Methanothermobacter
thermautotrophicus) 		PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 VAL A 191
LEU A 585
SER A 194
ASP A 208
 None
 0.96A 2hdnF-2ycbA:
undetectable
2hdnG-2ycbA:
undetectable
2hdnH-2ycbA:
undetectable		 2hdnF-2ycbA:
19.88
2hdnG-2ycbA:
6.49
2hdnH-2ycbA:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ab4 ASPARTOKINASE

(Corynebacterium
glutamicum) 		PF00696
(AA_kinase)
PF01842
(ACT)
PF13840
(ACT_7) 		4 SER A 348
VAL A 350
LEU A 214
SER A 386
 None
 0.74A 2hdnF-3ab4A:
1.9
2hdnG-3ab4A:
undetectable
2hdnH-3ab4A:
undetectable		 2hdnF-3ab4A:
22.99
2hdnG-3ab4A:
6.87
2hdnH-3ab4A:
22.99
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.
3aex THREONINE SYNTHASE

(Thermus
thermophilus) 		PF00291
(PALP) 		4 VAL A 153
LEU A 107
THR A  57
ASP A  62
 None
 0.99A 2hdnF-3aexA:
2.8
2hdnG-3aexA:
undetectable
2hdnH-3aexA:
2.5		 2hdnF-3aexA:
22.22
2hdnG-3aexA:
7.06
2hdnH-3aexA:
22.22
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.
3af5 PUTATIVE
UNCHARACTERIZED
PROTEIN PH1404

(Pyrococcus
horikoshii) 		PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 VAL A 200
LEU A 600
SER A 203
ASP A 217
 None
 1.02A 2hdnF-3af5A:
2.2
2hdnG-3af5A:
undetectable
2hdnH-3af5A:
undetectable		 2hdnF-3af5A:
18.50
2hdnG-3af5A:
4.77
2hdnH-3af5A:
18.50
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.
3cji POLYPROTEIN

(Senecavirus A) 		PF00073
(Rhv)
no annotation 		4 SER C  49
LEU A 201
THR C 225
SER C  48
 None
 0.95A 2hdnF-3cjiC:
undetectable
2hdnG-3cjiC:
undetectable
2hdnH-3cjiC:
undetectable		 2hdnF-3cjiC:
19.44
2hdnG-3cjiC:
9.26
2hdnH-3cjiC:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3deg GTP-BINDING PROTEIN
LEPA

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		4 SER C  21
LEU C 209
THR C  53
SER C  18
 None
 1.04A 2hdnF-3degC:
9.1
2hdnG-3degC:
undetectable
2hdnH-3degC:
9.1		 2hdnF-3degC:
23.60
2hdnG-3degC:
4.64
2hdnH-3degC:
23.60
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.
3dqq PUTATIVE TRNA
SYNTHASE

(Salmonella
enterica) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		4 SER A 256
VAL A 254
SER A 313
ASP A 278
 None
 0.86A 2hdnF-3dqqA:
1.7
2hdnG-3dqqA:
undetectable
2hdnH-3dqqA:
1.8		 2hdnF-3dqqA:
21.92
2hdnG-3dqqA:
8.62
2hdnH-3dqqA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e7f 6-PHOSPHOGLUCONOLACT
ONASE

(Trypanosoma
brucei) 		PF01182
(Glucosamine_iso) 		4 SER A 173
LEU A 160
THR A 202
PRO A 205
 None
 0.88A 2hdnF-3e7fA:
undetectable
2hdnG-3e7fA:
undetectable
2hdnH-3e7fA:
undetectable		 2hdnF-3e7fA:
24.23
2hdnG-3e7fA:
10.37
2hdnH-3e7fA:
24.23
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.
3g0o 3-HYDROXYISOBUTYRATE
DEHYDROGENASE

(Salmonella
enterica) 		PF03446
(NAD_binding_2)
PF14833
(NAD_binding_11) 		4 SER A 168
LEU A 258
SER A 144
ASP A 124
 None
 0.88A 2hdnF-3g0oA:
2.7
2hdnG-3g0oA:
undetectable
2hdnH-3g0oA:
undetectable		 2hdnF-3g0oA:
21.93
2hdnG-3g0oA:
12.69
2hdnH-3g0oA:
21.93
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.
3ie1 RIBONUCLEASE
TTHA0252

(Thermus
thermophilus) 		PF00753
(Lactamase_B)
PF07521
(RMMBL)
PF10996
(Beta-Casp) 		4 VAL A  12
LEU A 386
SER A  15
ASP A  29
 None
 1.05A 2hdnF-3ie1A:
undetectable
2hdnG-3ie1A:
undetectable
2hdnH-3ie1A:
undetectable		 2hdnF-3ie1A:
22.89
2hdnG-3ie1A:
6.55
2hdnH-3ie1A:
22.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iv3 TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE 2

(Streptococcus
mutans) 		PF01791
(DeoC) 		4 SER A  66
LEU A   3
SER A  65
ASP A  16
 None
 0.98A 2hdnF-3iv3A:
2.2
2hdnG-3iv3A:
undetectable
2hdnH-3iv3A:
2.3		 2hdnF-3iv3A:
24.68
2hdnG-3iv3A:
9.88
2hdnH-3iv3A:
24.68
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.
3kd8 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Thermoplasma
acidophilum) 		PF01676
(Metalloenzyme)
PF10143
(PhosphMutase) 		4 SER A 150
VAL A 148
SER A 134
ASP A 129
 None
 1.02A 2hdnF-3kd8A:
undetectable
2hdnG-3kd8A:
undetectable
2hdnH-3kd8A:
undetectable		 2hdnF-3kd8A:
23.09
2hdnG-3kd8A:
6.17
2hdnH-3kd8A:
23.09
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.
3lb9 ENDO-1,4-BETA-XYLANA
SE

(Bacillus
circulans) 		PF00457
(Glyco_hydro_11) 		4 SER A 165
VAL A 163
LEU A  39
ASP A 148
 None
 1.06A 2hdnF-3lb9A:
undetectable
2hdnG-3lb9A:
undetectable
2hdnH-3lb9A:
undetectable		 2hdnF-3lb9A:
17.46
2hdnG-3lb9A:
13.14
2hdnH-3lb9A:
17.46
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.
3m1a PUTATIVE
DEHYDROGENASE

(Streptomyces
avermitilis) 		PF00106
(adh_short) 		4 VAL A  84
LEU A 247
THR A 241
SER A 132
 None
 1.06A 2hdnF-3m1aA:
5.1
2hdnG-3m1aA:
undetectable
2hdnH-3m1aA:
4.3		 2hdnF-3m1aA:
24.93
2hdnG-3m1aA:
8.37
2hdnH-3m1aA:
24.93
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.
3m1y PHOSPHOSERINE
PHOSPHATASE (SERB)

(Helicobacter
pylori) 		PF00702
(Hydrolase) 		4 SER A 117
LEU A 127
SER A  96
ASP A  10
 None
 1.06A 2hdnF-3m1yA:
2.3
2hdnG-3m1yA:
undetectable
2hdnH-3m1yA:
undetectable		 2hdnF-3m1yA:
21.99
2hdnG-3m1yA:
15.13
2hdnH-3m1yA:
21.99
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.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		4 SER A 152
VAL A 154
LEU A 326
SER A 117
 None
 0.69A 2hdnF-3mc2A:
undetectable
2hdnG-3mc2A:
undetectable
2hdnH-3mc2A:
undetectable		 2hdnF-3mc2A:
20.87
2hdnG-3mc2A:
4.75
2hdnH-3mc2A:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mg0 PROTEASOME COMPONENT
PRE6

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		4 SER C  72
SER C 219
ASP C 218
PRO C 143
 None
 0.96A 2hdnF-3mg0C:
undetectable
2hdnG-3mg0C:
undetectable
2hdnH-3mg0C:
undetectable		 2hdnF-3mg0C:
20.00
2hdnG-3mg0C:
10.81
2hdnH-3mg0C:
20.00
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.
3mg0 PROTEASOME COMPONENT
PRE6

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		4 SER C  72
VAL C  74
SER C 219
ASP C 218
 None
 0.79A 2hdnF-3mg0C:
undetectable
2hdnG-3mg0C:
undetectable
2hdnH-3mg0C:
undetectable		 2hdnF-3mg0C:
20.00
2hdnG-3mg0C:
10.81
2hdnH-3mg0C:
20.00
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.
3pqd L-LACTATE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 VAL A 185
LEU A 261
SER A 152
ASP A 151
 None
 1.03A 2hdnF-3pqdA:
2.9
2hdnG-3pqdA:
undetectable
2hdnH-3pqdA:
4.7		 2hdnF-3pqdA:
22.75
2hdnG-3pqdA:
9.82
2hdnH-3pqdA:
22.75
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.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		4 VAL A 735
LEU A 324
THR A 663
PRO A 746
 None
 1.03A 2hdnF-3qdeA:
undetectable
2hdnG-3qdeA:
undetectable
2hdnH-3qdeA:
undetectable		 2hdnF-3qdeA:
17.14
2hdnG-3qdeA:
4.57
2hdnH-3qdeA:
17.14
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.
3qvf FOMA PROTEIN

(Streptomyces
wedmorensis) 		PF00696
(AA_kinase) 		4 SER A 148
LEU A 201
THR A 168
SER A 149
 FV1  A4001 (-2.6A)
ADP  A1260 (-4.1A)
None
FV1  A4001 (-2.6A)
 1.02A 2hdnF-3qvfA:
2.4
2hdnG-3qvfA:
undetectable
2hdnH-3qvfA:
undetectable		 2hdnF-3qvfA:
21.49
2hdnG-3qvfA:
12.24
2hdnH-3qvfA:
21.49
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.
3r4i CITRATE LYASE

(Paraburkholderia
xenovorans) 		PF03328
(HpcH_HpaI) 		4 SER A 221
VAL A 219
THR A 114
SER A 172
 None
 0.74A 2hdnF-3r4iA:
3.3
2hdnG-3r4iA:
undetectable
2hdnH-3r4iA:
3.2		 2hdnF-3r4iA:
23.24
2hdnG-3r4iA:
8.08
2hdnH-3r4iA:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 SER A 667
VAL A 665
THR A 699
SER A 615
 None
 1.06A 2hdnF-3syjA:
undetectable
2hdnG-3syjA:
undetectable
2hdnH-3syjA:
undetectable		 2hdnF-3syjA:
15.04
2hdnG-3syjA:
3.57
2hdnH-3syjA:
15.04
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.
3tha TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Campylobacter
jejuni) 		PF00290
(Trp_syntA) 		4 SER A  37
LEU A  19
THR A  84
ASP A  35
 None
 0.94A 2hdnF-3thaA:
undetectable
2hdnG-3thaA:
undetectable
2hdnH-3thaA:
3.1		 2hdnF-3thaA:
23.63
2hdnG-3thaA:
13.67
2hdnH-3thaA:
23.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		4 VAL A1129
LEU A1102
SER A1127
ASP A1082
 None
 1.04A 2hdnF-4amcA:
undetectable
2hdnG-4amcA:
undetectable
2hdnH-4amcA:
undetectable		 2hdnF-4amcA:
14.74
2hdnG-4amcA:
3.42
2hdnH-4amcA:
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ay7 METHYLCOBALAMIN:
COENZYME M
METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF01208
(URO-D) 		4 SER A  67
VAL A 334
LEU A  13
THR A  33
 None
 0.98A 2hdnF-4ay7A:
undetectable
2hdnG-4ay7A:
undetectable
2hdnH-4ay7A:
undetectable		 2hdnF-4ay7A:
24.18
2hdnG-4ay7A:
10.45
2hdnH-4ay7A:
24.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fus RTX TOXINS AND
RELATED CA2+-BINDING
PROTEIN

(Hahella
chejuensis) 		PF02011
(Glyco_hydro_48) 		4 VAL A  71
LEU A 636
SER A 213
ASP A 441
 None
None
NA  A 828 ( 4.5A)
NA  A 828 (-3.3A)
 0.90A 2hdnF-4fusA:
undetectable
2hdnG-4fusA:
undetectable
2hdnH-4fusA:
undetectable		 2hdnF-4fusA:
19.19
2hdnG-4fusA:
4.83
2hdnH-4fusA:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fwm PROPIONATE KINASE

(Salmonella
enterica) 		PF00871
(Acetate_kinase) 		4 VAL A 139
LEU A  22
THR A 177
SER A  97
 None
 0.96A 2hdnF-4fwmA:
3.0
2hdnG-4fwmA:
undetectable
2hdnH-4fwmA:
2.7		 2hdnF-4fwmA:
20.33
2hdnG-4fwmA:
9.59
2hdnH-4fwmA:
20.33
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.
4gs5 ACYL-COA SYNTHETASE
(AMP-FORMING)/AMP-AC
ID LIGASE II-LIKE
PROTEIN

(Dyadobacter
fermentans) 		PF00501
(AMP-binding) 		4 VAL A 124
LEU A 161
THR A 140
PRO A 112
 None
 1.03A 2hdnF-4gs5A:
undetectable
2hdnG-4gs5A:
undetectable
2hdnH-4gs5A:
undetectable		 2hdnF-4gs5A:
20.64
2hdnG-4gs5A:
8.85
2hdnH-4gs5A:
20.64
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.
4i9a QUINOLINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Sus scrofa) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 SER A 268
VAL A 266
SER A 248
ASP A 222
 NCN  A 301 (-3.4A)
None
NCN  A 301 (-2.9A)
NCN  A 301 (-3.3A)
 1.05A 2hdnF-4i9aA:
2.4
2hdnG-4i9aA:
undetectable
2hdnH-4i9aA:
undetectable		 2hdnF-4i9aA:
22.42
2hdnG-4i9aA:
7.94
2hdnH-4i9aA:
22.42
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.
4igl YENB

(Yersinia
entomophaga) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 SER A 193
LEU A  55
SER A  80
PRO A  99
 None
 0.86A 2hdnF-4iglA:
undetectable
2hdnG-4iglA:
undetectable
2hdnH-4iglA:
undetectable		 2hdnF-4iglA:
12.74
2hdnG-4iglA:
3.86
2hdnH-4iglA:
12.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca) 		PF02011
(Glyco_hydro_48) 		4 VAL A  39
LEU A 604
SER A 182
ASP A 408
 None
None
CA  A 704 ( 4.8A)
CA  A 704 (-3.3A)
 0.92A 2hdnF-4jjjA:
undetectable
2hdnG-4jjjA:
undetectable
2hdnH-4jjjA:
undetectable		 2hdnF-4jjjA:
19.44
2hdnG-4jjjA:
4.61
2hdnH-4jjjA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k6l CYTOLETHAL
DISTENDING TOXIN
SUBUNIT B HOMOLOG
PUTATIVE
PERTUSSIS-LIKE TOXIN
SUBUNIT

(Salmonella
enterica) 		PF02917
(Pertussis_S1)
PF03372
(Exo_endo_phos) 		4 SER G  39
LEU F 219
ASP G  36
PRO F 242
 None
 1.01A 2hdnF-4k6lG:
undetectable
2hdnG-4k6lG:
undetectable
2hdnH-4k6lG:
undetectable		 2hdnF-4k6lG:
20.00
2hdnG-4k6lG:
11.17
2hdnH-4k6lG:
20.00
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.
4kdr 3-DEMETHYLUBIQUINONE
-9
3-METHYLTRANSFERASE

(Escherichia
coli) 		PF13489
(Methyltransf_23) 		4 SER A  73
LEU A 225
THR A 127
ASP A  62
 None
None
None
SAH  A 301 ( 4.5A)
 0.92A 2hdnF-4kdrA:
2.9
2hdnG-4kdrA:
undetectable
2hdnH-4kdrA:
undetectable		 2hdnF-4kdrA:
20.82
2hdnG-4kdrA:
10.94
2hdnH-4kdrA:
20.82
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.
4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC

(Shewanella
oneidensis) 		PF14522
(Cytochrome_C7) 		4 SER A 437
VAL A 439
THR A 419
ASP A 393
 None
 1.05A 2hdnF-4lm8A:
undetectable
2hdnG-4lm8A:
undetectable
2hdnH-4lm8A:
undetectable		 2hdnF-4lm8A:
19.21
2hdnG-4lm8A:
4.82
2hdnH-4lm8A:
19.21
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.
4ln1 L-LACTATE
DEHYDROGENASE 1

(Bacillus cereus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 VAL A 185
LEU A 261
SER A 152
ASP A 151
 None
 0.92A 2hdnF-4ln1A:
2.8
2hdnG-4ln1A:
undetectable
2hdnH-4ln1A:
2.7		 2hdnF-4ln1A:
23.66
2hdnG-4ln1A:
8.17
2hdnH-4ln1A:
23.66
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.
4m7g TRYPSIN-LIKE
PROTEASE

(Saccharopolyspora
erythraea) 		PF00089
(Trypsin) 		4 VAL A 144
LEU A 189
THR A 174
ASP A 173
 None
 1.04A 2hdnF-4m7gA:
undetectable
2hdnG-4m7gA:
undetectable
2hdnH-4m7gA:
undetectable		 2hdnF-4m7gA:
22.70
2hdnG-4m7gA:
8.70
2hdnH-4m7gA:
22.70
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.
4pag PERIPLASMIC BINDING
PROTEIN

(Sulfurospirillum
deleyianum) 		PF01497
(Peripla_BP_2) 		4 SER A  63
LEU A 117
ASP A  69
PRO A 288
 None
 1.04A 2hdnF-4pagA:
2.4
2hdnG-4pagA:
undetectable
2hdnH-4pagA:
2.4		 2hdnF-4pagA:
22.55
2hdnG-4pagA:
8.68
2hdnH-4pagA:
22.55
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.
4pka PATATIN-17

(Solanum
cardiophyllum) 		PF01734
(Patatin) 		4 SER X  33
VAL X  31
THR X 299
SER X 257
 None
 0.99A 2hdnF-4pkaX:
undetectable
2hdnG-4pkaX:
undetectable
2hdnH-4pkaX:
undetectable		 2hdnF-4pkaX:
22.72
2hdnG-4pkaX:
8.52
2hdnH-4pkaX:
22.72
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.
4pz2 ZMALDH

(Zea mays) 		PF00171
(Aldedh) 		4 SER A 215
THR A 132
SER A 187
ASP A 136
 None
 1.04A 2hdnF-4pz2A:
undetectable
2hdnG-4pz2A:
undetectable
2hdnH-4pz2A:
undetectable		 2hdnF-4pz2A:
23.28
2hdnG-4pz2A:
5.72
2hdnH-4pz2A:
23.28
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.
4r5o QUINONPROTEIN
ALCOHOL
DEHYDROGENASE-LIKE
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF16819
(DUF5074)
PF16820
(PKD_3) 		4 SER A  48
VAL A  50
SER A 114
ASP A  97
 7PE  A 502 ( 4.5A)
None
7PE  A 502 ( 3.7A)
7PE  A 502 (-3.5A)
 1.00A 2hdnF-4r5oA:
undetectable
2hdnG-4r5oA:
undetectable
2hdnH-4r5oA:
undetectable		 2hdnF-4r5oA:
22.39
2hdnG-4r5oA:
8.04
2hdnH-4r5oA:
22.39
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.
4rdc AMINO ACID/AMIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, HAAT FAMILY

(Trichormus
variabilis) 		PF13458
(Peripla_BP_6) 		4 SER A 137
LEU A 256
THR A 103
PRO A 129
 None
 0.92A 2hdnF-4rdcA:
2.7
2hdnG-4rdcA:
undetectable
2hdnH-4rdcA:
2.9		 2hdnF-4rdcA:
21.48
2hdnG-4rdcA:
7.94
2hdnH-4rdcA:
21.48
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.
4xd0 TDP-3-AMINOQUINOVOSE
-N-FORMYLTRANSFERASE

(Providencia
alcalifaciens) 		PF00551
(Formyl_trans_N)
PF12796
(Ank_2) 		4 SER A 241
LEU A 267
SER A 243
PRO A 245
 K  A 404 (-4.9A)
None
None
K  A 404 ( 4.8A)
 1.05A 2hdnF-4xd0A:
undetectable
2hdnG-4xd0A:
undetectable
2hdnH-4xd0A:
undetectable		 2hdnF-4xd0A:
21.01
2hdnG-4xd0A:
8.49
2hdnH-4xd0A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z11 AURONE SYNTHASE

(Coreopsis
grandiflora) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL)
PF12143
(PPO1_KFDV) 		4 SER A 251
VAL A 255
LEU A 129
ASP A 153
 None
 1.06A 2hdnF-4z11A:
undetectable
2hdnG-4z11A:
undetectable
2hdnH-4z11A:
undetectable		 2hdnF-4z11A:
21.47
2hdnG-4z11A:
6.81
2hdnH-4z11A:
21.47
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.
4z8z UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 4 LEU A  98
SER A 269
ASP A 272
PRO A 211
 None
 1.02A 2hdnF-4z8zA:
3.3
2hdnG-4z8zA:
undetectable
2hdnH-4z8zA:
3.2		 2hdnF-4z8zA:
19.79
2hdnG-4z8zA:
7.69
2hdnH-4z8zA:
19.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4zv4 ELONGATION FACTOR TU

(Pseudomonas
aeruginosa) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		4 THR A  26
SER A  66
ASP A  81
PRO A  83
 MG  A 502 ( 3.1A)
None
MG  A 502 (-3.7A)
MG  A 502 ( 4.1A)
 0.56A 2hdnF-4zv4A:
41.6
2hdnG-4zv4A:
undetectable
2hdnH-4zv4A:
41.7		 2hdnF-4zv4A:
84.41
2hdnG-4zv4A:
64.44
2hdnH-4zv4A:
84.41
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.
5ck3 PUTATIVE SIGNAL
RECOGNITION PARTICLE
PROTEIN
SRX DOMAIN

(Chaetomium
thermophilum) 		PF04086
(SRP-alpha_N)
PF09439
(SRPRB) 		4 SER A  12
VAL A  14
LEU B 115
SER B 107
 None
None
None
GTP  B 402 ( 2.3A)
 0.81A 2hdnF-5ck3A:
undetectable
2hdnG-5ck3A:
undetectable
2hdnH-5ck3A:
undetectable		 2hdnF-5ck3A:
21.36
2hdnG-5ck3A:
21.33
2hdnH-5ck3A:
21.36
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.
5f5w GLYCINE--TRNA LIGASE
ALPHA SUBUNIT

(Aquifex
aeolicus) 		PF02091
(tRNA-synt_2e) 		4 SER A 220
VAL A 224
LEU A  43
ASP A 234
 None
 1.06A 2hdnF-5f5wA:
undetectable
2hdnG-5f5wA:
undetectable
2hdnH-5f5wA:
undetectable		 2hdnF-5f5wA:
21.84
2hdnG-5f5wA:
8.79
2hdnH-5f5wA:
21.84
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.
5gxf ACRYLYL-COA
REDUCTASE ACUI

(Ruegeria
pomeroyi) 		PF00107
(ADH_zinc_N) 		4 VAL A 324
LEU A 316
SER A  40
ASP A  67
 None
 1.06A 2hdnF-5gxfA:
undetectable
2hdnG-5gxfA:
undetectable
2hdnH-5gxfA:
2.7		 2hdnF-5gxfA:
23.86
2hdnG-5gxfA:
10.95
2hdnH-5gxfA:
23.86
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.
5hop LMO0182 PROTEIN

(Listeria
monocytogenes) 		no annotation 4 SER A  76
LEU A 171
THR A 136
ASP A  84
 None
 0.97A 2hdnF-5hopA:
undetectable
2hdnG-5hopA:
undetectable
2hdnH-5hopA:
undetectable		 2hdnF-5hopA:
21.49
2hdnG-5hopA:
14.47
2hdnH-5hopA:
21.49
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 VAL A1363
LEU A1105
SER A1361
PRO A1075
 None
 1.03A 2hdnF-5ip9A:
undetectable
2hdnG-5ip9A:
undetectable
2hdnH-5ip9A:
undetectable		 2hdnF-5ip9A:
13.62
2hdnG-5ip9A:
2.20
2hdnH-5ip9A:
13.62
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.
5ldn ANTIBODY

(Mus musculus) 		no annotation 5 VAL H 153
LEU H 173
THR H 120
SER H 205
PRO H 122
 None
 1.49A 2hdnF-5ldnH:
undetectable
2hdnG-5ldnH:
undetectable
2hdnH-5ldnH:
undetectable		 2hdnF-5ldnH:
19.02
2hdnG-5ldnH:
9.64
2hdnH-5ldnH:
19.02
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.
5m2n ELONGATOR COMPLEX
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 SER A 775
VAL A 773
THR A  54
SER A 779
 None
 1.01A 2hdnF-5m2nA:
undetectable
2hdnG-5m2nA:
undetectable
2hdnH-5m2nA:
undetectable		 2hdnF-5m2nA:
18.83
2hdnG-5m2nA:
4.78
2hdnH-5m2nA:
18.83
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		4 SER A 741
VAL A 743
LEU A 713
SER A 703
 None
 1.04A 2hdnF-5m60A:
undetectable
2hdnG-5m60A:
undetectable
2hdnH-5m60A:
undetectable		 2hdnF-5m60A:
17.96
2hdnG-5m60A:
4.17
2hdnH-5m60A:
17.96
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.
5mxf PHOTORHABDUS
ASYMBIOTICA LECTIN
PHL

(Photorhabdus
asymbiotica) 		PF03984
(DUF346) 		4 VAL A  36
LEU A  74
SER A  39
ASP A  40
 None
None
None
NA  A 405 (-2.8A)
 0.99A 2hdnF-5mxfA:
undetectable
2hdnG-5mxfA:
undetectable
2hdnH-5mxfA:
undetectable		 2hdnF-5mxfA:
19.90
2hdnG-5mxfA:
7.05
2hdnH-5mxfA:
19.90
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.
5n2g DNA POLYMERASE

(Vaccinia virus) 		no annotation 4 SER A 680
LEU A 510
THR A 567
SER A 683
 None
 1.04A 2hdnF-5n2gA:
5.4
2hdnG-5n2gA:
undetectable
2hdnH-5n2gA:
5.4		 2hdnF-5n2gA:
12.13
2hdnG-5n2gA:
16.18
2hdnH-5n2gA:
12.13
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.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 4 SER B 170
VAL B 172
LEU B 428
THR B 151
 None
 0.93A 2hdnF-5n5nB:
2.4
2hdnG-5n5nB:
undetectable
2hdnH-5n5nB:
2.5		 2hdnF-5n5nB:
23.21
2hdnG-5n5nB:
6.10
2hdnH-5n5nB:
23.21
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.
5nxy OSMOTICALLY
ACTIVATED
L-CARNITINE/CHOLINE
ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN OPUCC

(Bacillus
subtilis) 		no annotation 4 SER A 216
VAL A 218
LEU A  72
ASP A 101
 None
 1.05A 2hdnF-5nxyA:
undetectable
2hdnG-5nxyA:
undetectable
2hdnH-5nxyA:
undetectable		 2hdnF-5nxyA:
11.68
2hdnG-5nxyA:
21.05
2hdnH-5nxyA:
11.68
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.
5o8o MITOCHONDRIAL IMPORT
RECEPTOR SUBUNIT
TOM40

(Neurospora
crassa) 		PF01459
(Porin_3) 		4 SER A 222
VAL A 220
SER A 234
ASP A 248
 None
 0.78A 2hdnF-5o8oA:
undetectable
2hdnG-5o8oA:
undetectable
2hdnH-5o8oA:
undetectable		 2hdnF-5o8oA:
21.39
2hdnG-5o8oA:
10.64
2hdnH-5o8oA:
21.39
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.
5oc1 ARYL-ALCOHOL OXIDASE

(Pleurotus
eryngii) 		no annotation 4 SER A  87
LEU A 310
ASP A  60
PRO A  79
 FAD  A 602 (-2.8A)
None
None
FAD  A 602 (-4.3A)
 0.99A 2hdnF-5oc1A:
undetectable
2hdnG-5oc1A:
undetectable
2hdnH-5oc1A:
undetectable		 2hdnF-5oc1A:
19.52
2hdnG-5oc1A:
6.14
2hdnH-5oc1A:
19.52
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.
5tr0 SEED LINOLEATE
13S-LIPOXYGENASE-1

(Glycine max) 		no annotation 4 SER A 464
VAL A 466
LEU A 362
SER A 451
 None
 0.99A 2hdnF-5tr0A:
undetectable
2hdnG-5tr0A:
undetectable
2hdnH-5tr0A:
undetectable		 2hdnF-5tr0A:
18.29
2hdnG-5tr0A:
4.81
2hdnH-5tr0A:
18.29
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.
5txf PHOSPHATIDYLCHOLINE-
STEROL
ACYLTRANSFERASE

(Homo sapiens) 		no annotation 4 VAL A 381
LEU A  32
THR A 347
ASP A 345
 None
 0.99A 2hdnF-5txfA:
2.3
2hdnG-5txfA:
undetectable
2hdnH-5txfA:
undetectable		 2hdnF-5txfA:
23.64
2hdnG-5txfA:
7.47
2hdnH-5txfA:
23.64
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.
5ufl PROTEIN CIP2A

(Homo sapiens) 		no annotation 4 SER A 201
VAL A 204
LEU A 118
ASP A 246
 None
 1.00A 2hdnF-5uflA:
undetectable
2hdnG-5uflA:
undetectable
2hdnH-5uflA:
undetectable		 2hdnF-5uflA:
20.50
2hdnG-5uflA:
5.78
2hdnH-5uflA:
20.50
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.
5uy7 PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Burkholderia
ambifaria) 		PF00905
(Transpeptidase) 		4 SER A 516
VAL A 518
LEU A 386
SER A 533
 None
 0.83A 2hdnF-5uy7A:
undetectable
2hdnG-5uy7A:
undetectable
2hdnH-5uy7A:
undetectable		 2hdnF-5uy7A:
21.23
2hdnG-5uy7A:
5.83
2hdnH-5uy7A:
21.23
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.
5x3h URACIL-DNA
GLYCOSYLASE

(Nitratifractor
salsuginis) 		no annotation 4 SER A 162
LEU A 228
ASP A 250
PRO A 248
 None
 0.95A 2hdnF-5x3hA:
undetectable
2hdnG-5x3hA:
undetectable
2hdnH-5x3hA:
undetectable		 2hdnF-5x3hA:
21.83
2hdnG-5x3hA:
13.42
2hdnH-5x3hA:
21.83
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT

(Komagataella
phaffii) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		4 VAL A1366
LEU A1107
SER A1364
PRO A1077
 None
 1.04A 2hdnF-5xogA:
2.2
2hdnG-5xogA:
undetectable
2hdnH-5xogA:
2.2		 2hdnF-5xogA:
12.56
2hdnG-5xogA:
2.50
2hdnH-5xogA:
12.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y4d ANKYRIN-1,ANKYRIN-2,
ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		4 LEU A2182
THR A2160
ASP A2162
PRO A1624
 None
 1.05A 2hdnF-5y4dA:
undetectable
2hdnG-5y4dA:
undetectable
2hdnH-5y4dA:
undetectable		 2hdnF-5y4dA:
20.03
2hdnG-5y4dA:
6.50
2hdnH-5y4dA:
20.03
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.
6am0 KLLA0A01474P
KLLA0F23980P

(Kluyveromyces
lactis) 		no annotation 4 SER A  35
THR C 363
ASP A  33
PRO A  31
 None
 1.01A 2hdnF-6am0A:
undetectable
2hdnG-6am0A:
undetectable
2hdnH-6am0A:
undetectable		 2hdnF-6am0A:
14.83
2hdnG-6am0A:
14.29
2hdnH-6am0A:
14.83
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.
6bk1 UDP-GLYCOSYLTRANSFER
ASE 79

(Oryza sativa) 		no annotation 4 SER A 390
VAL A 393
LEU A 350
ASP A 385
 None
 0.94A 2hdnF-6bk1A:
2.5
2hdnG-6bk1A:
undetectable
2hdnH-6bk1A:
3.1		 2hdnF-6bk1A:
11.93
2hdnG-6bk1A:
19.23
2hdnH-6bk1A:
11.93
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.
6f9m SERINE PROTEASE

(Planococcus
plakortidis) 		no annotation 4 SER A 152
VAL A 150
LEU A 306
THR A  93
 None
 1.05A 2hdnF-6f9mA:
undetectable
2hdnG-6f9mA:
undetectable
2hdnH-6f9mA:
undetectable		 2hdnF-6f9mA:
13.92
2hdnG-6f9mA:
22.78
2hdnH-6f9mA:
13.92
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.
6fay ODZ3 PROTEIN

(Mus musculus) 		no annotation 4 SER A1829
LEU A1791
SER A1830
ASP A2081
 None
 0.92A 2hdnF-6fayA:
undetectable
2hdnG-6fayA:
undetectable
2hdnH-6fayA:
undetectable		 2hdnF-6fayA:
13.43
2hdnG-6fayA:
18.99
2hdnH-6fayA:
13.43
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.
6g72 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Mus musculus) 		no annotation 4 SER H 110
VAL H 113
LEU H 285
SER H 109
 None
 0.95A 2hdnF-6g72H:
undetectable
2hdnG-6g72H:
undetectable
2hdnH-6g72H:
undetectable		 2hdnF-6g72H:
12.54
2hdnG-6g72H:
16.44
2hdnH-6g72H:
12.54