SIMILAR PATTERNS OF AMINO ACIDS FOR 2NNH_B_9CRB501_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.
1a2z PYRROLIDONE CARBOXYL
PEPTIDASE

(Thermococcus
litoralis) 		PF01470
(Peptidase_C15) 		5 ILE A  23
VAL A 168
PRO A 169
ILE A  77
VAL A  79
 None
 1.20A 2nnhB-1a2zA:
undetectable		 2nnhB-1a2zA:
18.43
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.
1abr ABRIN-A

(Abrus
precatorius) 		PF00161
(RIP)
PF00652
(Ricin_B_lectin) 		5 GLY A 204
SER A 208
ILE A  36
VAL A 237
VAL B 222
 None
 1.22A 2nnhB-1abrA:
undetectable		 2nnhB-1abrA:
18.95
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.
1ccw PROTEIN (GLUTAMATE
MUTASE)

(Clostridium
cochlearium) 		PF06368
(Met_asp_mut_E) 		5 GLY B  68
THR B 347
PRO B  92
ILE B 324
VAL B 323
 None
 1.30A 2nnhB-1ccwB:
0.0		 2nnhB-1ccwB:
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.
1e8c UDP-N-ACETYLMURAMOYL
ALANYL-D-GLUTAMATE--
2,6-DIAMINOPIMELATE
LIGASE

(Escherichia
coli) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 SER A 292
THR A 122
VAL A 258
ILE A 237
VAL A 202
 None
 1.33A 2nnhB-1e8cA:
0.0		 2nnhB-1e8cA:
21.12
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.
1fez PHOSPHONOACETALDEHYD
E HYDROLASE

(Bacillus cereus) 		PF13419
(HAD_2) 		5 GLY A 119
ILE A 112
THR A  16
VAL A   9
ILE A  10
 None
 1.23A 2nnhB-1fezA:
0.0		 2nnhB-1fezA:
20.04
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.
1gju MALTODEXTRIN
GLYCOSYLTRANSFERASE

(Thermotoga
maritima) 		PF00128
(Alpha-amylase)
PF09083
(DUF1923) 		5 GLY A 611
ILE A 608
THR A 579
VAL A 596
ILE A 597
 None
 1.31A 2nnhB-1gjuA:
0.0		 2nnhB-1gjuA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1idu VANADIUM
CHLOROPEROXIDASE

(Curvularia
inaequalis) 		PF01569
(PAP2) 		5 GLY A 409
ILE A 307
THR A 314
VAL A 415
VAL A 423
 None
 1.20A 2nnhB-1iduA:
0.2		 2nnhB-1iduA:
20.12
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.
1imv PIGMENT
EPITHELIUM-DERIVED
FACTOR

(Homo sapiens) 		PF00079
(Serpin) 		5 GLY A 189
ILE A 160
THR A 150
VAL A 123
ILE A 183
 None
 1.36A 2nnhB-1imvA:
0.0		 2nnhB-1imvA:
23.29
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.
1iy1 ATP-DEPENDENT
METALLOPROTEASE FTSH

(Thermus
thermophilus) 		PF00004
(AAA) 		5 GLY A 201
ILE A 321
VAL A 209
ILE A 251
VAL A 296
 ADP  A   1 (-3.0A)
None
None
None
None
 1.35A 2nnhB-1iy1A:
undetectable		 2nnhB-1iy1A:
20.04
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.
1kuu CONSERVED PROTEIN

(Methanothermobacter) 		PF07826
(IMP_cyclohyd) 		5 GLY A  10
ILE A 170
THR A  32
ILE A  62
VAL A  39
 None
 1.17A 2nnhB-1kuuA:
undetectable		 2nnhB-1kuuA:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 GLY A 157
THR A 359
VAL A 151
ILE A 122
VAL A 123
 None
 1.19A 2nnhB-1lgfA:
29.2		 2nnhB-1lgfA:
23.61
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.
1llc L-LACTATE
DEHYDROGENASE

(Lactobacillus
casei) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  30
THR A 149
VAL A  27
ILE A 123
VAL A 124
 None
 1.29A 2nnhB-1llcA:
undetectable		 2nnhB-1llcA:
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.
1mro METHYL-COENZYME M
REDUCTASE

(Methanothermobacter
marburgensis) 		PF02240
(MCR_gamma) 		5 GLY C  41
ILE C  85
THR C 140
VAL C  36
ILE C  31
 None
 1.34A 2nnhB-1mroC:
undetectable		 2nnhB-1mroC:
18.16
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.
1no5 HYPOTHETICAL PROTEIN
HI0073

(Haemophilus
influenzae) 		PF01909
(NTP_transf_2) 		5 GLY A  39
SER A  35
ILE A   9
VAL A  99
VAL A  30
 None
ZN  A 501 ( 4.2A)
None
None
None
 1.27A 2nnhB-1no5A:
undetectable		 2nnhB-1no5A:
13.67
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.
1odf HYPOTHETICAL 33.3
KDA PROTEIN IN
ADE3-SER2 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		no annotation 5 GLY A 160
ILE A 207
THR A 284
ILE A 275
VAL A 281
 None
None
GOL  A 504 (-4.0A)
None
None
 1.32A 2nnhB-1odfA:
undetectable		 2nnhB-1odfA:
22.18
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.
1r44 D-ALANYL-D-ALANINE
DIPEPTIDASE

(Enterococcus
faecium) 		PF01427
(Peptidase_M15) 		5 GLY A 138
SER A 156
THR A  59
VAL A 135
PRO A 136
 None
 1.12A 2nnhB-1r44A:
undetectable		 2nnhB-1r44A:
16.28
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.
1sp3 CYTOCHROME C,
PUTATIVE

(Shewanella
oneidensis) 		PF11783
(Cytochrome_cB)
PF13435
(Cytochrome_C554) 		5 GLY A 369
ILE A 337
THR A 392
VAL A  65
ILE A  60
 None
 1.24A 2nnhB-1sp3A:
undetectable		 2nnhB-1sp3A:
19.64
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.
1sy7 CATALASE 1

(Neurospora
crassa) 		PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel) 		5 GLY A 729
THR A 687
VAL A 671
ILE A 666
VAL A 662
 None
 1.32A 2nnhB-1sy7A:
undetectable		 2nnhB-1sy7A:
21.89
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 GLY A 533
ILE A 373
VAL A 584
ILE A 398
VAL A 399
 None
 1.11A 2nnhB-1z8lA:
undetectable		 2nnhB-1z8lA:
21.29
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.
1zjy R-SPECIFIC ALCOHOL
DEHYDROGENASE

(Lactobacillus
brevis) 		PF13561
(adh_short_C2) 		5 GLY A  51
SER A  49
VAL A  33
ILE A  11
VAL A  87
 None
 1.12A 2nnhB-1zjyA:
undetectable		 2nnhB-1zjyA:
19.87
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.
2c06 KID TOXIN PROTEIN

(Escherichia
coli) 		PF02452
(PemK_toxin) 		5 GLY A  86
ILE A  80
VAL A  25
ILE A  27
VAL A  28
 None
 1.21A 2nnhB-2c06A:
undetectable		 2nnhB-2c06A:
12.36
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.
2d3t 3-KETOACYL-COA
THIOLASE

(Pseudomonas
fragi) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY C  60
SER C  98
ILE C  39
VAL C  57
VAL C 116
 None
 1.16A 2nnhB-2d3tC:
undetectable		 2nnhB-2d3tC:
21.38
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.
2ef7 HYPOTHETICAL PROTEIN
ST2348

(Sulfurisphaera
tokodaii) 		PF00571
(CBS) 		5 GLY A 108
VAL A  41
PRO A  46
ILE A  39
VAL A  38
 None
 1.09A 2nnhB-2ef7A:
undetectable		 2nnhB-2ef7A:
14.96
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.
2gjt RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE PTPRO

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 GLY A1130
ILE A1133
VAL A1092
ILE A1083
VAL A1065
 None
 0.85A 2nnhB-2gjtA:
undetectable		 2nnhB-2gjtA:
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.
2gp6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 195
SER A 110
ILE A 412
THR A   6
ILE A 184
 None
 1.25A 2nnhB-2gp6A:
undetectable		 2nnhB-2gp6A:
20.52
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.
2hi6 UPF0107 PROTEIN
AF0055

(Archaeoglobus
fulgidus) 		PF01989
(DUF126) 		5 GLY A  93
ILE A  81
THR A  20
ILE A  30
VAL A  37
 None
 1.17A 2nnhB-2hi6A:
undetectable		 2nnhB-2hi6A:
15.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 ARG A 362
GLY A 365
ILE A 348
VAL A 404
VAL A 515
 None
 1.19A 2nnhB-2hnhA:
undetectable		 2nnhB-2hnhA:
19.34
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.
2iwz 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ARG A  94
GLY A  95
THR A 236
VAL A  92
PRO A  93
 None
 1.33A 2nnhB-2iwzA:
undetectable		 2nnhB-2iwzA:
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.
2ix2 DNA POLYMERASE
SLIDING CLAMP B

(Sulfolobus
solfataricus) 		PF00705
(PCNA_N) 		5 GLY A 224
SER A 198
ILE A 166
VAL A 221
VAL A 209
 None
 1.34A 2nnhB-2ix2A:
undetectable		 2nnhB-2ix2A:
19.09
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.
2j66 BTRK

(Bacillus
circulans) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 GLY A 243
ILE A 198
THR A 205
VAL A 249
ILE A  42
 None
EDO  A1418 (-3.9A)
None
None
None
 1.29A 2nnhB-2j66A:
undetectable		 2nnhB-2j66A:
22.63
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.
2k22 PUTATIVE
UNCHARACTERIZED
PROTEIN TA0895

(Thermoplasma
acidophilum) 		PF02597
(ThiS) 		5 ILE A  24
THR A  73
VAL A   2
ILE A  81
VAL A  60
 None
 1.36A 2nnhB-2k22A:
undetectable		 2nnhB-2k22A:
11.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2myf RRM CONTAINING
CYCLOPHILIN

(Plasmodium
falciparum) 		PF00076
(RRM_1) 		5 GLY A  32
SER A  29
VAL A  54
ILE A  37
VAL A  39
 None
 1.32A 2nnhB-2myfA:
undetectable		 2nnhB-2myfA:
10.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2nnj CYTOCHROME P450 2C8

(Homo sapiens) 		PF00067
(p450) 		7 ARG A  97
GLY A  98
SER A 100
ILE A 113
THR A 301
ILE A 476
VAL A 477
 HEM  A 500 (-2.6A)
None
None
225  A 501 ( 4.3A)
HEM  A 500 ( 3.7A)
225  A 501 ( 3.9A)
None
 0.93A 2nnhB-2nnjA:
61.9		 2nnhB-2nnjA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2nnj CYTOCHROME P450 2C8

(Homo sapiens) 		PF00067
(p450) 		8 ARG A  97
SER A 100
ILE A 113
THR A 301
VAL A 366
PRO A 367
ILE A 476
VAL A 477
 HEM  A 500 (-2.6A)
None
225  A 501 ( 4.3A)
HEM  A 500 ( 3.7A)
225  A 501 ( 3.7A)
225  A 501 ( 4.7A)
225  A 501 ( 3.9A)
None
 0.67A 2nnhB-2nnjA:
61.9		 2nnhB-2nnjA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2nnj CYTOCHROME P450 2C8

(Homo sapiens) 		PF00067
(p450) 		6 ARG A  97
SER A 103
VAL A 366
PRO A 367
ILE A 476
VAL A 477
 HEM  A 500 (-2.6A)
225  A 501 ( 4.0A)
225  A 501 ( 3.7A)
225  A 501 ( 4.7A)
225  A 501 ( 3.9A)
None
 1.12A 2nnhB-2nnjA:
61.9		 2nnhB-2nnjA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2og7 ASPARAGINE OXYGENASE

(Streptomyces
coelicolor) 		PF02668
(TauD) 		5 ARG A  79
GLY A  80
THR A 185
VAL A  77
VAL A 280
 None
 1.25A 2nnhB-2og7A:
undetectable		 2nnhB-2og7A:
20.89
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.
2q2v BETA-D-HYDROXYBUTYRA
TE DEHYDROGENASE

(Pseudomonas
putida) 		PF00106
(adh_short) 		5 GLY A  20
ILE A 180
THR A 163
VAL A  85
VAL A 115
 None
 1.07A 2nnhB-2q2vA:
undetectable		 2nnhB-2q2vA:
21.11
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.
2rij PUTATIVE
2,3,4,5-TETRAHYDROPY
RIDINE-2-CARBOXYLATE
N-
SUCCINYLTRANSFERASE

(Campylobacter
jejuni) 		PF14602
(Hexapep_2)
PF14789
(THDPS_M)
PF14790
(THDPS_N) 		5 GLY A 275
SER A 302
ILE A 260
THR A 251
VAL A 256
 CL  A 387 ( 3.8A)
None
None
None
None
 1.36A 2nnhB-2rijA:
undetectable		 2nnhB-2rijA:
21.43
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.
2vfk AKAP18 DELTA

(Homo sapiens) 		PF10469
(AKAP7_NLS) 		5 GLY A 289
ILE A 286
THR A 207
VAL A 160
ILE A 200
 None
 1.26A 2nnhB-2vfkA:
undetectable		 2nnhB-2vfkA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ztu D(-)-3-HYDROXYBUTYRA
TE DEHYDROGENASE

(Pseudomonas
fragi) 		PF13561
(adh_short_C2) 		5 GLY A  19
ILE A 183
THR A 166
VAL A  88
VAL A 118
 None
 1.02A 2nnhB-2ztuA:
undetectable		 2nnhB-2ztuA:
19.50
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.
3bkx SAM-DEPENDENT
METHYLTRANSFERASE

(Lactobacillus
paracasei) 		PF13649
(Methyltransf_25) 		5 GLY A 270
ILE A  34
VAL A 126
ILE A  46
VAL A  70
 None
 1.19A 2nnhB-3bkxA:
undetectable		 2nnhB-3bkxA:
20.17
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.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 GLY A 505
ILE A 501
THR A 564
VAL A 546
ILE A 538
 None
 1.32A 2nnhB-3bmwA:
undetectable		 2nnhB-3bmwA:
21.60
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.
3efm FERRIC ALCALIGIN
SIDEROPHORE RECEPTOR

(Bordetella
pertussis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 GLY A 536
SER A 538
VAL A  57
ILE A 132
VAL A 150
 None
 0.93A 2nnhB-3efmA:
undetectable		 2nnhB-3efmA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3euc HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE 2

(Cupriavidus
pinatubonensis) 		PF00155
(Aminotran_1_2) 		5 GLY A 239
ILE A  96
VAL A 195
ILE A 159
VAL A 111
 None
 0.92A 2nnhB-3eucA:
undetectable		 2nnhB-3eucA:
19.87
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 ARG A1566
GLY A1569
ILE A1533
VAL A1572
ILE A1557
 None
 1.31A 2nnhB-3hmjA:
undetectable		 2nnhB-3hmjA:
13.55
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.
3icu E3 UBIQUITIN-PROTEIN
LIGASE RNF128

(Homo sapiens) 		PF02225
(PA) 		5 GLY A 172
ILE A 179
VAL A 144
ILE A 193
VAL A  80
 None
 1.25A 2nnhB-3icuA:
undetectable		 2nnhB-3icuA:
17.36
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.
3igh UNCHARACTERIZED
METAL-DEPENDENT
HYDROLASE

(Pyrococcus
horikoshii) 		PF07969
(Amidohydro_3) 		5 GLY X 412
SER X 414
ILE X 353
THR X 317
VAL X 277
 None
 1.08A 2nnhB-3ighX:
undetectable		 2nnhB-3ighX:
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.
3j9q SHEATH

(Pseudomonas
aeruginosa) 		PF04984
(Phage_sheath_1)
PF17482
(Phage_sheath_1C) 		5 GLY A 268
ILE A 226
VAL A 181
ILE A 155
VAL A 129
 None
 1.16A 2nnhB-3j9qA:
undetectable		 2nnhB-3j9qA:
20.94
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.
3jy6 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Lactobacillus
brevis) 		PF13407
(Peripla_BP_4) 		5 GLY A 313
ILE A 306
PRO A 147
ILE A  70
VAL A  72
 None
 1.28A 2nnhB-3jy6A:
undetectable		 2nnhB-3jy6A:
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.
3ne2 PROBABLE AQUAPORIN
AQPM

(Archaeoglobus
fulgidus) 		PF00230
(MIP) 		5 ARG A  95
GLY A  94
SER A  92
VAL A 167
ILE A 162
 None
 1.20A 2nnhB-3ne2A:
undetectable		 2nnhB-3ne2A:
20.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ono RIBOSE/GALACTOSE
ISOMERASE

(Vibrio
parahaemolyticus) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		5 GLY A  90
ILE A 129
VAL A  68
ILE A   3
VAL A  33
 None
 1.06A 2nnhB-3onoA:
undetectable		 2nnhB-3onoA:
18.34
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.
3pps LACCASE

(Thielavia
arenaria) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 ARG A  33
GLY A  32
THR A  69
VAL A  35
ILE A  78
 None
 1.16A 2nnhB-3ppsA:
undetectable		 2nnhB-3ppsA:
22.36
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.
3q6v BETA-LACTAMASE

(Serratia
fonticola) 		PF00753
(Lactamase_B) 		5 GLY A  76
ILE A 109
THR A  86
VAL A  73
ILE A  83
 None
 1.11A 2nnhB-3q6vA:
undetectable		 2nnhB-3q6vA:
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.
3r9l NUCLEOSIDE
DIPHOSPHATE KINASE

(Giardia
intestinalis) 		PF00334
(NDK) 		5 ARG A 104
GLY A 105
ILE A 116
THR A   6
VAL A  82
 None
 1.22A 2nnhB-3r9lA:
undetectable		 2nnhB-3r9lA:
16.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tk3 CYTOCHROME P450 2B4

(Oryctolagus
cuniculus) 		PF00067
(p450) 		5 ARG A  98
ILE A 114
THR A 302
VAL A 367
PRO A 368
 HEM  A 500 (-2.9A)
HEM  A 500 (-4.0A)
CPZ  A 501 ( 3.7A)
HEM  A 500 ( 4.3A)
None
 0.69A 2nnhB-3tk3A:
45.9		 2nnhB-3tk3A:
55.46
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.
3w7b FORMYLTETRAHYDROFOLA
TE DEFORMYLASE

(Thermus
thermophilus) 		PF00551
(Formyl_trans_N)
PF01842
(ACT) 		5 GLY A 164
ILE A 156
VAL A 168
ILE A 189
VAL A 224
 None
 1.24A 2nnhB-3w7bA:
undetectable		 2nnhB-3w7bA:
20.93
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.
4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0

(synthetic
construct) 		PF00218
(IGPS) 		5 GLY A 153
SER A 151
THR A  84
VAL A 130
ILE A 113
 None
 1.33A 2nnhB-4a29A:
undetectable		 2nnhB-4a29A:
20.70
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.
4a5a NUCLEOSIDE-TRIPHOSPH
ATASE 1

(Toxoplasma
gondii) 		PF01150
(GDA1_CD39) 		5 GLY A 574
ILE A 285
THR A 490
PRO A 578
ILE A 581
 None
 1.32A 2nnhB-4a5aA:
undetectable		 2nnhB-4a5aA:
21.09
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.
4ags THIOL-DEPENDENT
REDUCTASE 1

(Leishmania
infantum) 		PF13417
(GST_N_3)
PF16865
(GST_C_5) 		5 ARG A 314
GLY A 315
VAL A 312
PRO A 313
VAL A 327
 None
EDO  A1452 (-3.4A)
None
None
None
 1.04A 2nnhB-4agsA:
undetectable		 2nnhB-4agsA:
21.78
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.
4ak1 BT_4661

(Bacteroides
thetaiotaomicron) 		PF16319
(DUF4958) 		5 GLY A  24
SER A  26
THR A 144
VAL A 110
PRO A 109
 None
 1.10A 2nnhB-4ak1A:
undetectable		 2nnhB-4ak1A:
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.
4d5g CYCLOHEXANE-1,2-DION
E HYDROLASE

(Azoarcus sp.
BH72) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ARG A 179
GLY A 180
VAL A 177
PRO A 178
ILE A 143
 None
 1.15A 2nnhB-4d5gA:
undetectable		 2nnhB-4d5gA:
20.89
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.
4eys MCCC FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF02016
(Peptidase_S66) 		5 GLY A 325
ILE A 245
VAL A 322
PRO A 323
ILE A 162
 None
 1.27A 2nnhB-4eysA:
undetectable		 2nnhB-4eysA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fg0 POLYPROTEIN

(Saint Louis
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		5 GLY A 321
ILE A 324
VAL A 375
PRO A 377
ILE A 384
 None
 1.31A 2nnhB-4fg0A:
undetectable		 2nnhB-4fg0A:
22.67
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.
4g4s PROTEASOME CHAPERONE
1

(Saccharomyces
cerevisiae) 		PF10450
(POC1) 		5 GLY O 147
SER O 143
VAL O  33
PRO O  34
VAL O  30
 None
 1.33A 2nnhB-4g4sO:
undetectable		 2nnhB-4g4sO:
20.71
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.
4hci CUPREDOXIN 1

(Bacillus
anthracis) 		PF13473
(Cupredoxin_1) 		5 GLY A 124
VAL A  47
PRO A  56
ILE A  45
VAL A  44
 None
 1.25A 2nnhB-4hciA:
undetectable		 2nnhB-4hciA:
11.82
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.
4i8q PUTATIVE BETAINE
ALDEHYDE
DEHYROGENASE

(Solanum
lycopersicum) 		PF00171
(Aldedh) 		5 GLY A 156
ILE A 213
VAL A 172
ILE A 169
VAL A 114
 None
 1.19A 2nnhB-4i8qA:
undetectable		 2nnhB-4i8qA:
21.06
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.
4j3b M1 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 GLY A 357
THR A 327
VAL A 341
ILE A 218
VAL A 227
 None
 1.32A 2nnhB-4j3bA:
undetectable		 2nnhB-4j3bA:
19.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j8l UNCHARACTERIZED
PROTEIN YHFS

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 GLY A  73
ILE A  79
VAL A 206
ILE A 216
VAL A 212
 None
 1.18A 2nnhB-4j8lA:
undetectable		 2nnhB-4j8lA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jnq THIOREDOXIN
REDUCTASE

(Brucella
melitensis) 		PF07992
(Pyr_redox_2) 		5 GLY A 247
THR A 239
VAL A 152
ILE A 205
VAL A 224
 None
 1.36A 2nnhB-4jnqA:
undetectable		 2nnhB-4jnqA:
19.96
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.
4lsb LYASE/MUTASE

(Burkholderia
cenocepacia) 		PF13714
(PEP_mutase) 		5 ARG A 239
GLY A  52
SER A  50
THR A 191
VAL A 209
 CL  A 502 (-4.3A)
None
MG  A 501 (-2.5A)
None
None
 1.22A 2nnhB-4lsbA:
undetectable		 2nnhB-4lsbA:
18.28
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.
4nv7 ARYLAMINE
N-ACETYLTRANSFERASE

(Mesorhizobium
japonicum) 		PF00797
(Acetyltransf_2) 		5 GLY A  50
ILE A 258
VAL A 208
ILE A 273
VAL A 274
 None
 1.25A 2nnhB-4nv7A:
undetectable		 2nnhB-4nv7A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nvt TRIOSEPHOSPHATE
ISOMERASE

(Brucella
melitensis) 		PF00121
(TIM) 		5 GLY A  19
THR A  93
VAL A  46
ILE A  44
VAL A  43
 None
 1.26A 2nnhB-4nvtA:
undetectable		 2nnhB-4nvtA:
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.
4o4x TBPB

(Glaesserella
parasuis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 GLY A 178
ILE A 114
VAL A  53
PRO A  54
VAL A  50
 None
 1.35A 2nnhB-4o4xA:
undetectable		 2nnhB-4o4xA:
21.22
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 SER A 960
ILE A 938
VAL A 933
ILE A 907
VAL A 903
 None
 1.35A 2nnhB-4q73A:
undetectable		 2nnhB-4q73A:
18.15
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.
4um8 INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 418
THR A 582
VAL A 440
PRO A 439
ILE A 441
 SO4  A1598 (-3.7A)
None
None
None
None
 1.32A 2nnhB-4um8A:
undetectable		 2nnhB-4um8A:
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.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		5 ARG A 242
GLY A 245
VAL A 238
ILE A 210
VAL A 212
 None
 1.31A 2nnhB-4wgxA:
undetectable		 2nnhB-4wgxA:
22.09
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.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		5 GLY A 245
THR A 260
VAL A 238
ILE A 210
VAL A 212
 None
 1.16A 2nnhB-4wgxA:
undetectable		 2nnhB-4wgxA:
22.09
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.
4wp3 MA1120

(Mycobacterium
avium) 		PF00211
(Guanylate_cyc) 		5 GLY A 106
ILE A 144
VAL A 109
ILE A  57
VAL A  56
 None
 1.27A 2nnhB-4wp3A:
undetectable		 2nnhB-4wp3A:
17.68
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.
4wy4 SYNAPTOSOMAL-ASSOCIA
TED PROTEIN 29
SYNTAXIN-17
VESICLE-ASSOCIATED
MEMBRANE PROTEIN 8

(Homo sapiens) 		PF00957
(Synaptobrevin)
no annotation 		5 ARG A  37
GLY A  38
ILE D 227
VAL B 193
VAL B 186
 None
 1.24A 2nnhB-4wy4A:
undetectable		 2nnhB-4wy4A:
8.35
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.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		5 GLY A1079
ILE A 900
VAL A 881
ILE A 877
VAL A 874
 None
 1.16A 2nnhB-4xqkA:
undetectable		 2nnhB-4xqkA:
14.34
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.
4za2 2-DEOXY-D-GLUCONATE
3-DEHYDROGENASE

(Pectobacterium
carotovorum) 		PF13561
(adh_short_C2) 		5 GLY A  25
ILE A 186
THR A 169
VAL A  90
VAL A 120
 None
 1.17A 2nnhB-4za2A:
undetectable		 2nnhB-4za2A:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 ARG A1029
GLY A1028
ILE A1032
VAL A 961
VAL A1208
 None
 1.36A 2nnhB-4zhjA:
undetectable		 2nnhB-4zhjA:
16.26
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.
5c5g SPHERULIN-4

(Aspergillus
clavatus) 		PF12138
(Spherulin4) 		5 GLY A 194
THR A 129
VAL A 187
ILE A 143
VAL A 139
 None
 1.31A 2nnhB-5c5gA:
undetectable		 2nnhB-5c5gA:
22.10
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.
5fyn PUUMALA VIRUS GN
GLYCOPROTEIN

(Puumala
orthohantavirus) 		PF01567
(Hanta_G1) 		5 GLY A  43
ILE A  46
THR A 369
PRO A 265
ILE A 256
 None
 1.36A 2nnhB-5fynA:
undetectable		 2nnhB-5fynA:
22.15
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.
5gai PORTAL PROTEIN

(Salmonella
virus P22) 		PF16510
(P22_portal) 		5 ILE A 333
VAL A 397
PRO A 398
ILE A 340
VAL A 341
 None
 1.07A 2nnhB-5gaiA:
undetectable		 2nnhB-5gaiA:
20.19
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT DELTA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		5 ARG d 380
GLY d 201
ILE d 353
THR d 364
VAL d 378
 None
 1.05A 2nnhB-5gw5d:
undetectable		 2nnhB-5gw5d:
22.12
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.
5h8y SULFITE REDUCTASE
[FERREDOXIN],
CHLOROPLASTIC

(Zea mays) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLY A 390
THR A 213
VAL A 339
ILE A 313
VAL A 298
 None
 1.30A 2nnhB-5h8yA:
undetectable		 2nnhB-5h8yA:
21.75
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.
5had PROTEIN ACCUMULATION
AND REPLICATION OF
CHLOROPLASTS 6,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF13355
(DUF4101) 		5 GLY A 747
THR A 780
VAL A 784
ILE A 682
VAL A 683
 None
EDO  A 901 ( 4.5A)
None
None
None
 1.21A 2nnhB-5hadA:
undetectable		 2nnhB-5hadA:
17.49
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.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 GLY A1011
SER A1016
ILE A1000
ILE A 989
VAL A 985
 None
 1.07A 2nnhB-5kf7A:
undetectable		 2nnhB-5kf7A:
16.04
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.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93

(Porphyromonas
gingivalis) 		no annotation 5 GLY A 461
ILE A 464
VAL A 482
ILE A 503
VAL A 515
 None
 1.11A 2nnhB-5m11A:
undetectable		 2nnhB-5m11A:
20.47
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		5 SER A 741
ILE A 708
THR A 628
VAL A 698
VAL A 615
 None
 1.13A 2nnhB-5m60A:
undetectable		 2nnhB-5m60A:
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 ARG A3655
GLY A3658
VAL A3653
ILE A3662
VAL A3648
 None
 1.27A 2nnhB-5nugA:
undetectable		 2nnhB-5nugA:
7.38
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.
5ujp GLYOXALASE/BLEOMYCIN
RESISANCE
PROTEIN/DIOXYGENASE

(Streptomyces
sp. CB03234) 		PF00903
(Glyoxalase) 		5 GLY A 111
ILE A 114
THR A  52
VAL A  11
PRO A  12
 None
None
CA  A 201 (-3.8A)
None
None
 1.26A 2nnhB-5ujpA:
undetectable		 2nnhB-5ujpA:
14.53
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.
5uwv L,D-TRANSPEPTIDASE 2

(Mycobacteroides
abscessus) 		no annotation 5 GLY B 389
ILE B 330
THR B 275
VAL B 372
VAL B 254
 None
 1.11A 2nnhB-5uwvB:
undetectable		 2nnhB-5uwvB:
20.72
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.
5vdn GLUTATHIONE
OXIDOREDUCTASE

(Yersinia pestis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A  25
SER A  29
ILE A  20
THR A 285
VAL A 305
 FAD  A 502 (-3.6A)
None
FAD  A 502 (-4.9A)
None
None
 0.82A 2nnhB-5vdnA:
undetectable		 2nnhB-5vdnA:
23.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wbg CYTOCHROME P450 2B6

(Homo sapiens) 		no annotation 5 ARG A  98
ILE A 114
THR A 302
VAL A 367
PRO A 368
 HEM  A 501 (-2.8A)
9ZJ  A 502 ( 3.6A)
9ZJ  A 502 ( 3.9A)
9ZJ  A 502 ( 4.2A)
None
 0.53A 2nnhB-5wbgA:
44.6		 2nnhB-5wbgA:
61.25
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.
5xap PROTEIN TRANSLOCASE
SUBUNIT SECD

(Deinococcus
radiodurans) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		5 GLY A 536
SER A 538
ILE A 541
VAL A 526
ILE A 569
 None
 1.28A 2nnhB-5xapA:
undetectable		 2nnhB-5xapA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cri -

(-) 		no annotation 5 GLY M 330
ILE M 341
THR M 422
VAL M 295
ILE M 279
 None
 1.20A 2nnhB-6criM:
undetectable		 2nnhB-6criM:
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.
6eoq DIPEPTIDYL PEPTIDASE
9

(Homo sapiens) 		no annotation 5 GLY A 646
SER A 682
ILE A 702
VAL A 643
VAL A 675
 None
 1.14A 2nnhB-6eoqA:
undetectable		 2nnhB-6eoqA:
10.90
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.
6f2d FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIP
FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIR

(Salmonella
enterica) 		no annotation 5 ARG A 168
ILE A 169
PRO F  56
ILE F  54
VAL F 151
 None
 1.30A 2nnhB-6f2dA:
undetectable		 2nnhB-6f2dA:
9.29