SIMILAR PATTERNS OF AMINO ACIDS FOR 2XRZ_A_ACTA1470_0

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.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		4 ARG P 217
ALA P 212
ASP P 211
GLU P 215
 None
None
NDG  P 602 (-3.9A)
None
 0.89A 2xrzA-1e33P:
0.8		 2xrzA-1e33P:
23.14
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.
1e6y METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanosarcina
barkeri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		4 ARG A1308
ALA A1534
ASP A1535
GLU A1201
 None
 1.10A 2xrzA-1e6yA:
0.0		 2xrzA-1e6yA:
22.44
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.
1ixp PYRIDOXINE
5'-PHOSPHATE
SYNTHASE

(Escherichia
coli) 		PF03740
(PdxJ) 		4 ARG A 221
ALA A 230
ASP A 229
GLU A 233
 None
 1.50A 2xrzA-1ixpA:
1.1		 2xrzA-1ixpA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpy CATECHOL
2,3-DIOXYGENASE

(Pseudomonas
putida) 		PF00903
(Glyoxalase) 		4 ARG A  14
ALA A  60
ASP A  61
GLU A  62
 None
 1.44A 2xrzA-1mpyA:
undetectable		 2xrzA-1mpyA:
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.
1o7l TRANSCRIPTIONAL
REGULATOR MODE

(Escherichia
coli) 		PF00126
(HTH_1)
PF03459
(TOBE) 		4 ARG A  21
ALA A  51
ASP A  50
GLU A  54
 None
 1.33A 2xrzA-1o7lA:
undetectable		 2xrzA-1o7lA:
18.60
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.
1o9r AGROBACTERIUM
TUMEFACIENS DPS

(Agrobacterium
tumefaciens) 		PF00210
(Ferritin) 		4 ARG A 113
ALA A 109
ASP A 108
GLU A 112
 None
 1.38A 2xrzA-1o9rA:
undetectable		 2xrzA-1o9rA:
16.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qlm METHENYLTETRAHYDROME
THANOPTERIN
CYCLOHYDROLASE

(Methanopyrus
kandleri) 		PF02289
(MCH) 		4 ARG A 225
ALA A 216
ASP A 217
GLU A 221
 None
 1.50A 2xrzA-1qlmA:
undetectable		 2xrzA-1qlmA:
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.
1zuk MYOSIN TAIL
REGION-INTERACTING
PROTEIN MTI1

(Saccharomyces
cerevisiae) 		PF00018
(SH3_1) 		4 ALA A  40
ASP A  39
GLU A  41
TRP A  42
 None
MG  A2001 ( 4.2A)
MG  A2001 (-4.6A)
None
 1.36A 2xrzA-1zukA:
undetectable		 2xrzA-1zukA:
9.87
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.
2btv PROTEIN (VP3 CORE
PROTEIN)

(Bluetongue
virus) 		PF01700
(Orbi_VP3) 		4 ARG A 215
ALA A 690
ASP A 696
GLU A 211
 None
 1.49A 2xrzA-2btvA:
undetectable		 2xrzA-2btvA:
18.87
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.
2bvg 6-HYDROXY-D-NICOTINE
OXIDASE

(Paenarthrobacter
nicotinovorans) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		4 ARG A 276
ALA A 233
ASP A 232
GLU A 236
 None
 1.17A 2xrzA-2bvgA:
0.0		 2xrzA-2bvgA:
24.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2glx 1,5-ANHYDRO-D-FRUCTO
SE REDUCTASE

(Ensifer
adhaerens) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ARG A 140
ALA A 135
ASP A 134
GLU A 138
 None
 1.02A 2xrzA-2glxA:
1.3		 2xrzA-2glxA:
20.97
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.
2i62 NICOTINAMIDE
N-METHYLTRANSFERASE

(Mus musculus) 		PF01234
(NNMT_PNMT_TEMT) 		4 ARG A 178
ALA A 225
ASP A 224
GLU A 228
 None
 0.76A 2xrzA-2i62A:
2.5		 2xrzA-2i62A:
23.62
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.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		4 ARG A  76
ALA A 105
ASP A 108
GLU A 103
 None
 1.44A 2xrzA-2pg6A:
undetectable		 2xrzA-2pg6A:
22.84
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.
2pny ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE
2

(Homo sapiens) 		PF00293
(NUDIX) 		4 ARG A 111
ALA A 114
ASP A 164
GLU A 167
 POP  A 230 (-3.8A)
None
None
POP  A 230 ( 4.3A)
 1.15A 2xrzA-2pnyA:
undetectable		 2xrzA-2pnyA:
22.34
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.
2pok PEPTIDASE,
M20/M25/M40 FAMILY

(Streptococcus
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ARG A 176
ALA A 413
ASP A 412
GLU A 415
 None
 1.22A 2xrzA-2pokA:
undetectable		 2xrzA-2pokA:
22.26
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.
2r14 MORPHINONE REDUCTASE

(Pseudomonas
putida) 		PF00724
(Oxidored_FMN) 		4 ARG A 169
ALA A 225
ASP A 224
GLU A 228
 None
 1.05A 2xrzA-2r14A:
undetectable		 2xrzA-2r14A:
21.72
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.
2v4n MULTIFUNCTIONAL
PROTEIN SUR E

(Salmonella
enterica) 		PF01975
(SurE) 		4 ARG A 172
ALA A 216
ASP A 218
GLU A 219
 None
 1.29A 2xrzA-2v4nA:
1.8		 2xrzA-2v4nA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vqx METALLOPROTEINASE

(Serratia
proteamaculans) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
PF16485
(PLN_propep) 		4 ARG A 152
ALA A  89
ASP A  91
GLU A  92
 None
 1.05A 2xrzA-2vqxA:
undetectable		 2xrzA-2vqxA:
21.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2xry DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE

(Methanosarcina
mazei) 		PF00875
(DNA_photolyase) 		5 ARG A 256
ALA A 297
ASP A 300
GLU A 301
TRP A 305
 None
None
None
FAD  A1463 (-3.9A)
GOL  A1474 ( 3.4A)
 0.37A 2xrzA-2xryA:
61.7		 2xrzA-2xryA:
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.
3d34 SPONDIN-2

(Homo sapiens) 		PF06468
(Spond_N) 		4 ARG A 128
ALA A  72
ASP A 134
TRP A 135
 None
None
CA  A 228 (-2.3A)
None
 1.36A 2xrzA-3d34A:
undetectable		 2xrzA-3d34A:
17.84
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.
3h7u ALDO-KETO REDUCTASE

(Arabidopsis
thaliana) 		PF00248
(Aldo_ket_red) 		4 ARG A  98
ALA A  95
ASP A  91
GLU A  94
 None
 1.32A 2xrzA-3h7uA:
undetectable		 2xrzA-3h7uA:
24.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hps 2-ISOPROPYLMALATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF00682
(HMGL-like)
PF08502
(LeuA_dimer) 		4 ARG A 272
ASP A 265
GLU A 268
TRP A  63
 None
 1.31A 2xrzA-3hpsA:
undetectable		 2xrzA-3hpsA:
21.46
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.
3hpx 2-ISOPROPYLMALATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF00682
(HMGL-like) 		4 ARG A 272
ASP A 265
GLU A 268
TRP A  63
 None
 1.36A 2xrzA-3hpxA:
undetectable		 2xrzA-3hpxA:
21.72
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.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 ARG A 386
ALA A 672
ASP A 671
GLU A 389
 None
 1.45A 2xrzA-3k30A:
undetectable		 2xrzA-3k30A:
21.19
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.
3kda CFTR INHIBITORY
FACTOR (CIF)

(Pseudomonas
aeruginosa) 		no annotation 4 ARG D 256
ALA D 284
ASP D 286
GLU D 285
 None
 1.34A 2xrzA-3kdaD:
undetectable		 2xrzA-3kdaD:
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.
3kdn RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Thermococcus
kodakarensis) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 ARG A 240
ALA A 232
ASP A 233
GLU A 236
 None
 1.25A 2xrzA-3kdnA:
undetectable		 2xrzA-3kdnA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ll5 GAMMA-GLUTAMYL
KINASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF00696
(AA_kinase) 		4 ARG A  26
ALA A  87
ASP A  86
GLU A  90
 None
 1.41A 2xrzA-3ll5A:
3.1		 2xrzA-3ll5A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lsc TRIAZINE HYDROLASE

(Paenarthrobacter
aurescens) 		PF01979
(Amidohydro_1) 		4 ARG A 108
ALA A 144
ASP A 143
GLU A 147
 None
 0.85A 2xrzA-3lscA:
undetectable		 2xrzA-3lscA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n2c PROLIDASE

(unidentified) 		PF01979
(Amidohydro_1) 		4 ARG A 173
ALA A 214
ASP A 217
GLU A 218
 None
 1.12A 2xrzA-3n2cA:
undetectable		 2xrzA-3n2cA:
22.47
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.
3oaa ATP SYNTHASE GAMMA
CHAIN

(Escherichia
coli) 		PF00231
(ATP-synt) 		4 ARG G 163
ALA G 158
ASP G 160
GLU G 161
 None
 1.39A 2xrzA-3oaaG:
undetectable		 2xrzA-3oaaG:
20.78
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.
3ray PR DOMAIN-CONTAINING
PROTEIN 11

(Homo sapiens) 		PF00856
(SET) 		4 ARG A 141
ALA A  65
ASP A  63
GLU A 134
 None
 1.21A 2xrzA-3rayA:
undetectable		 2xrzA-3rayA:
19.25
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.
3rb9 DNA POLYMERASE III
SUBUNIT BETA

(Mycobacterium
tuberculosis) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		4 ARG A  19
ALA A  23
ASP A  24
GLU A  20
 None
 1.24A 2xrzA-3rb9A:
undetectable		 2xrzA-3rb9A:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vva ALTERNATIVE OXIDASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF01786
(AOX) 		4 ARG A 231
ALA A 226
ASP A 228
GLU A 229
 None
 1.43A 2xrzA-3vvaA:
undetectable		 2xrzA-3vvaA:
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.
4b7g CATALASE

(Corynebacterium
glutamicum) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 ARG A 506
ALA A 474
ASP A 475
GLU A 471
 None
 1.18A 2xrzA-4b7gA:
undetectable		 2xrzA-4b7gA:
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.
4cij GST REP

(Geobacillus
stearothermophilus) 		PF02486
(Rep_trans) 		4 ARG A 194
ALA A 118
ASP A 116
GLU A 196
 None
 1.12A 2xrzA-4cijA:
undetectable		 2xrzA-4cijA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cwe REPLICATION
INITIATION PROTEIN,
REPLICATION
INITIATION PROTEIN

(Staphylococcus
aureus) 		PF02486
(Rep_trans) 		4 ARG A 212
ALA A 144
ASP A 142
GLU A 214
 None
 1.38A 2xrzA-4cweA:
undetectable		 2xrzA-4cweA:
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.
4hn3 LMO1757 PROTEIN

(Listeria
monocytogenes) 		PF07537
(CamS) 		4 ARG A 298
ALA A 305
ASP A 341
GLU A 306
 None
 0.94A 2xrzA-4hn3A:
undetectable		 2xrzA-4hn3A:
21.46
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.
4htg PORPHOBILINOGEN
DEAMINASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		4 ARG A 188
ALA A 184
ASP A 114
GLU A 113
 None
 1.36A 2xrzA-4htgA:
undetectable		 2xrzA-4htgA:
21.33
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.
4mup AMIDOHYDROLASE

(Agrobacterium
fabrum) 		PF04909
(Amidohydro_2) 		4 ARG A 138
ALA A 134
ASP A 133
GLU A 137
 None
 1.32A 2xrzA-4mupA:
undetectable		 2xrzA-4mupA:
25.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o7h GLUTATHIONE
S-TRANSFERASE

(Rhodospirillum
rubrum) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		4 ARG A   2
ALA A  56
ASP A  57
GLU A  55
 None
 1.34A 2xrzA-4o7hA:
undetectable		 2xrzA-4o7hA:
18.69
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		4 ARG A 375
ALA A 370
ASP A 372
GLU A 373
 None
 1.42A 2xrzA-4u1rA:
2.0		 2xrzA-4u1rA:
20.29
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.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 ARG A 582
ALA A 699
ASP A 702
GLU A 703
 None
 1.38A 2xrzA-4wxxA:
undetectable		 2xrzA-4wxxA:
17.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wz9 AGAP004809-PA

(Anopheles
gambiae) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 ARG A 665
ALA A 702
ASP A 701
GLU A 705
 None
None
GOL  A1002 (-4.2A)
None
 1.38A 2xrzA-4wz9A:
2.9		 2xrzA-4wz9A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yzk TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Streptomyces
blastmyceticus) 		PF11991
(Trp_DMAT) 		4 ARG A 142
ALA A 138
ASP A 135
TRP A  83
 None
 1.49A 2xrzA-4yzkA:
undetectable		 2xrzA-4yzkA:
23.11
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.
5a7m BETA-XYLOSIDASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ALA A 494
ASP A 495
GLU A 214
TRP A 164
 None
 1.30A 2xrzA-5a7mA:
undetectable		 2xrzA-5a7mA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		4 ARG A 297
ALA A 516
ASP A 517
GLU A 190
 None
 1.15A 2xrzA-5a8rA:
2.5		 2xrzA-5a8rA:
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.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF01855
(POR_N)
PF17147
(PFOR_II) 		4 ARG A 152
ALA A 238
ASP A 240
GLU A 241
 None
 1.35A 2xrzA-5exeA:
undetectable		 2xrzA-5exeA:
23.03
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.
5h6o PORPHOBILINOGEN
DEAMINASE

(Vibrio cholerae) 		no annotation 4 ARG A 182
ALA A 178
ASP A 109
GLU A 108
 DPM  A 401 (-3.6A)
DPM  A 401 ( 4.4A)
None
None
 1.25A 2xrzA-5h6oA:
undetectable		 2xrzA-5h6oA:
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.
5ht0 AMINOGLYCOSIDE
ACETYLTRANSFERASE
HMB0005

(uncultured
bacterium) 		PF02522
(Antibiotic_NAT) 		4 ARG A 110
ALA A  63
ASP A  64
TRP A  65
 None
 1.17A 2xrzA-5ht0A:
undetectable		 2xrzA-5ht0A:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iuy MULTIDRUG EFFLUX
OUTER MEMBRANE
PROTEIN OPRN

(Pseudomonas
aeruginosa) 		PF02321
(OEP) 		4 ARG A 273
ALA A 133
ASP A 132
GLU A 136
 None
 0.81A 2xrzA-5iuyA:
undetectable		 2xrzA-5iuyA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kar ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3B

(Mus musculus) 		PF00149
(Metallophos) 		4 ARG A 188
ALA A 224
ASP A 227
GLU A 229
 None
 1.24A 2xrzA-5karA:
undetectable		 2xrzA-5karA:
22.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 4 ARG A 383
ALA A 380
GLU A 379
TRP A 376
 None
 1.50A 2xrzA-5nitA:
undetectable		 2xrzA-5nitA:
22.13
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.
5ov6 PORPHOBILINOGEN
DEAMINASE

(Bacillus
megaterium) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		4 ARG A 174
ALA A 170
ASP A 101
GLU A 100
 None
 1.48A 2xrzA-5ov6A:
undetectable		 2xrzA-5ov6A:
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.
5tky PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF00012
(HSP70) 		4 ARG A 349
ALA A 311
ASP A 308
GLU A 307
 None
 1.37A 2xrzA-5tkyA:
undetectable		 2xrzA-5tkyA:
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.
5tpt AMYLOID-LIKE PROTEIN
2

(Homo sapiens) 		no annotation 4 ARG A 459
ALA A 382
ASP A 383
GLU A 386
 None
 1.20A 2xrzA-5tptA:
undetectable		 2xrzA-5tptA:
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.
5w0t PROTEIN MSP1

(Saccharomyces
cerevisiae) 		PF00004
(AAA) 		4 ARG A 337
ALA A 309
ASP A 308
GLU A 312
 None
None
None
EDO  A 403 ( 4.3A)
 1.14A 2xrzA-5w0tA:
undetectable		 2xrzA-5w0tA:
22.47
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.
5wzr ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Bifidobacterium
bifidum) 		PF11308
(Glyco_hydro_129) 		4 ARG A 307
ALA A 355
ASP A 354
GLU A 358
 None
 1.34A 2xrzA-5wzrA:
undetectable		 2xrzA-5wzrA:
22.52
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.
5xb7 BETA-GALACTOSIDASE

(Bifidobacterium
animalis) 		no annotation 4 ARG A 601
ALA A 439
ASP A 438
GLU A 442
 SO4  A 810 (-3.0A)
None
None
SO4  A 810 (-4.2A)
 1.08A 2xrzA-5xb7A:
undetectable		 2xrzA-5xb7A:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xu6 INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Cryptococcus
neoformans) 		PF06090
(Ins_P5_2-kin) 		4 ALA A 398
ASP A 401
GLU A 402
TRP A 405
 None
 1.37A 2xrzA-5xu6A:
undetectable		 2xrzA-5xu6A:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6an0 HISTIDINOL
DEHYDROGENASE

(Elizabethkingia
anophelis) 		PF00815
(Histidinol_dh) 		4 ARG A 116
ALA A 115
GLU A 114
TRP A 112
 None
HIS  A 520 (-3.5A)
HIS  A 520 (-4.4A)
None
 1.50A 2xrzA-6an0A:
2.7		 2xrzA-6an0A:
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.
6b5c KATANIN P60
ATPASE-CONTAINING
SUBUNIT A-LIKE 1

(Homo sapiens) 		no annotation 4 ARG A 196
ALA A 193
ASP A 189
GLU A 192
 None
 1.30A 2xrzA-6b5cA:
undetectable		 2xrzA-6b5cA:
undetectable