SIMILAR PATTERNS OF AMINO ACIDS FOR 4XUM_B_IMNB501_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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri) 		PF01804
(Penicil_amidase) 		5 GLY A  93
ALA A  19
ILE A  17
LEU B  37
ILE A  90
 None
 1.15A 4xumB-1cp9A:
0.0		 4xumB-1cp9A:
20.77
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.
1g6q HNRNP ARGININE
N-METHYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF06325
(PrmA) 		5 GLY 1  68
CYH 1  67
SER 1  73
ALA 1  76
MET 1 143
 None
 1.07A 4xumB-1g6q1:
0.0		 4xumB-1g6q1:
22.25
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.
1jjf ENDO-1,4-BETA-XYLANA
SE Z

(Ruminiclostridium
thermocellum) 		PF00756
(Esterase) 		5 GLY A 268
ALA A 108
ILE A 122
LEU A  84
LEU A 281
 None
 1.15A 4xumB-1jjfA:
0.0		 4xumB-1jjfA:
20.81
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.
1jqk CARBON MONOXIDE
DEHYDROGENASE

(Rhodospirillum
rubrum) 		PF03063
(Prismane) 		5 GLY A 256
ALA A 387
ILE A 260
LEU A 280
ILE A 285
 None
 1.17A 4xumB-1jqkA:
0.0		 4xumB-1jqkA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kjn MTH0777

(Methanothermobacter
thermautotrophicus) 		PF09001
(DUF1890) 		5 GLY A  14
ALA A 108
ILE A 125
LEU A 121
LEU A 118
 None
 1.09A 4xumB-1kjnA:
undetectable		 4xumB-1kjnA:
23.16
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.
1ljy MGP-40

(Capra hircus) 		PF00704
(Glyco_hydro_18) 		5 GLY A 167
ALA A 155
ILE A 180
LEU A 182
LEU A 183
 None
 1.05A 4xumB-1ljyA:
0.0		 4xumB-1ljyA:
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.
1m32 2-AMINOETHYLPHOSPHON
ATE-PYRUVATE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00266
(Aminotran_5) 		5 GLY A 200
ALA A 252
ILE A  42
LEU A  46
MET A 169
 None
None
None
None
PLP  A4401 (-4.6A)
 1.18A 4xumB-1m32A:
0.0		 4xumB-1m32A:
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.
1pzx HYPOTHETICAL PROTEIN
APC36103

(Geobacillus
stearothermophilus) 		PF02645
(DegV) 		5 GLY A 232
SER A 123
ALA A 122
ILE A 267
ILE A 160
 None
PLM  A 702 (-3.7A)
PLM  A 702 ( 4.0A)
PLM  A 702 ( 4.4A)
None
 1.14A 4xumB-1pzxA:
undetectable		 4xumB-1pzxA:
23.42
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.
1qas PHOSPHOLIPASE C
DELTA-1

(Rattus
norvegicus) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 GLY A 433
SER A 381
ALA A 380
LEU A 340
ILE A 435
 None
 1.07A 4xumB-1qasA:
undetectable		 4xumB-1qasA:
22.01
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.
1rzr GLUCOSE-RESISTANCE
AMYLASE REGULATOR

(Bacillus
megaterium) 		no annotation 5 GLY G  64
ILE G  70
LEU G  78
ILE G 121
MET G 302
 None
 1.15A 4xumB-1rzrG:
undetectable		 4xumB-1rzrG:
24.14
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.
1su7 CARBON MONOXIDE
DEHYDROGENASE 2

(Carboxydothermus
hydrogenoformans) 		PF03063
(Prismane) 		5 GLY A 581
ALA A 444
ILE A 567
LEU A 576
ILE A 609
 None
 1.15A 4xumB-1su7A:
undetectable		 4xumB-1su7A:
18.62
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.
1vpv UPF0230 PROTEIN
TM1468

(Thermotoga
maritima) 		PF02645
(DegV) 		5 GLY A 280
SER A 122
ILE A 268
LEU A 193
ILE A 161
 PLM  A 501 (-3.8A)
PLM  A 501 (-3.7A)
PLM  A 501 ( 4.5A)
None
None
 1.17A 4xumB-1vpvA:
undetectable		 4xumB-1vpvA:
22.56
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.
1wdu TRAS1 ORF2P

(Bombyx mori) 		PF14529
(Exo_endo_phos_2) 		5 GLY A  67
ALA A  52
ILE A  54
LEU A 232
ILE A  42
 None
 1.08A 4xumB-1wduA:
undetectable		 4xumB-1wduA:
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.
1wh4 INTERLEUKIN-1
RECEPTOR-ASSOCIATED
KINASE 4

(Mus musculus) 		no annotation 5 GLY A  89
ALA A  45
ILE A  98
LEU A  77
ILE A  18
 None
 1.04A 4xumB-1wh4A:
undetectable		 4xumB-1wh4A:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wjo T-PLASTIN

(Homo sapiens) 		PF00307
(CH) 		5 GLY A 112
ALA A  81
ILE A  47
LEU A  46
ILE A  12
 None
 1.18A 4xumB-1wjoA:
undetectable		 4xumB-1wjoA:
17.23
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.
1wrb DJVLGB

(Dugesia
japonica) 		PF00270
(DEAD) 		5 CYH A 227
SER A 377
ALA A 344
ILE A 384
ILE A 224
 None
 1.02A 4xumB-1wrbA:
undetectable		 4xumB-1wrbA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wrb DJVLGB

(Dugesia
japonica) 		PF00270
(DEAD) 		5 CYH A 227
SER A 377
ALA A 344
ILE A 384
LEU A 392
 None
 1.00A 4xumB-1wrbA:
undetectable		 4xumB-1wrbA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a11 RIBONUCLEASE III

(Mycobacterium
tuberculosis) 		PF14622
(Ribonucleas_3_3) 		5 GLY A 121
ALA A 128
ILE A 129
LEU A  12
LEU A   9
 None
 1.19A 4xumB-2a11A:
undetectable		 4xumB-2a11A:
21.50
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.
2bbk METHYLAMINE
DEHYDROGENASE (HEAVY
SUBUNIT)

(Paracoccus
denitrificans) 		PF06433
(Me-amine-dh_H) 		5 ALA H 246
ILE H 239
LEU H 227
ILE H 171
MET H 128
 None
 1.16A 4xumB-2bbkH:
undetectable		 4xumB-2bbkH:
23.04
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.
2c2n MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Homo sapiens) 		PF00698
(Acyl_transf_1) 		5 GLY A  35
ALA A 320
ILE A 321
LEU A 195
MET A 157
 None
 1.16A 4xumB-2c2nA:
undetectable		 4xumB-2c2nA:
20.44
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.
2chg REPLICATION FACTOR C
SMALL SUBUNIT

(Archaeoglobus
fulgidus) 		PF00004
(AAA) 		5 GLY A 206
ILE A 173
LEU A 170
LEU A 186
ILE A 219
 None
 1.15A 4xumB-2chgA:
undetectable		 4xumB-2chgA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2chq REPLICATION FACTOR C
SMALL SUBUNIT

(Archaeoglobus
fulgidus) 		PF00004
(AAA)
PF08542
(Rep_fac_C) 		5 GLY A 206
ILE A 173
LEU A 170
LEU A 186
ILE A 219
 None
 0.98A 4xumB-2chqA:
undetectable		 4xumB-2chqA:
24.32
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.
2eq5 228AA LONG
HYPOTHETICAL
HYDANTOIN RACEMASE

(Pyrococcus
horikoshii) 		PF01177
(Asp_Glu_race) 		5 GLY A 101
SER A 206
ALA A 210
ILE A  27
LEU A   8
 None
 0.97A 4xumB-2eq5A:
undetectable		 4xumB-2eq5A:
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.
2gup ROK FAMILY PROTEIN

(Streptococcus
pneumoniae) 		PF00480
(ROK) 		5 GLY A 231
ALA A 119
ILE A 219
LEU A 216
ILE A 241
 SUC  A 290 ( 4.5A)
None
None
None
None
 1.15A 4xumB-2gupA:
undetectable		 4xumB-2gupA:
24.53
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.
2inf UROPORPHYRINOGEN
DECARBOXYLASE

(Bacillus
subtilis) 		PF01208
(URO-D) 		5 GLY A 285
ALA A 252
ILE A 279
LEU A 260
ILE A 242
 None
 1.03A 4xumB-2infA:
undetectable		 4xumB-2infA:
24.60
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.
2n1i PR DOMAIN ZINC
FINGER PROTEIN 16

(Homo sapiens) 		PF00856
(SET) 		5 SER A 167
ALA A 165
ILE A  78
LEU A  86
ILE A 172
 None
 1.19A 4xumB-2n1iA:
undetectable		 4xumB-2n1iA:
21.82
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.
2on5 NA GLUTATHIONE
S-TRANSFERASE 2

(Necator
americanus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 GLY A  79
SER A  72
ALA A  68
ILE A  21
LEU A 158
 None
None
EDO  A 425 ( 3.8A)
None
None
 1.19A 4xumB-2on5A:
undetectable		 4xumB-2on5A:
24.11
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.
2vc6 DIHYDRODIPICOLINATE
SYNTHASE

(Sinorhizobium
meliloti) 		PF00701
(DHDPS) 		5 GLY A  42
CYH A  41
ILE A  18
LEU A  23
LEU A  26
 MCL  A 161 ( 3.4A)
None
None
None
None
 1.01A 4xumB-2vc6A:
undetectable		 4xumB-2vc6A:
26.19
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.
2vjt ALLOPHYCOCYANIN BETA
SUBUNIT

(Gloeobacter
violaceus) 		PF00502
(Phycobilisome) 		5 GLY B 138
ALA B  55
MET B  85
LEU B  89
MET B  96
 None
None
CYC  B1081 ( 4.0A)
None
None
 1.14A 4xumB-2vjtB:
undetectable		 4xumB-2vjtB:
17.31
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.
2x58 PEROXISOMAL
BIFUNCTIONAL ENZYME

(Rattus
norvegicus) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A  52
ALA A 180
ILE A 181
LEU A   7
ILE A  14
 None
 1.14A 4xumB-2x58A:
undetectable		 4xumB-2x58A:
19.55
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 SER A  35
ALA A  56
ILE A  77
LEU A  81
ILE A  32
 None
 0.93A 4xumB-3a14A:
undetectable		 4xumB-3a14A:
24.30
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 SER A  35
ALA A  56
ILE A  77
LEU A  81
LEU A  84
 None
 0.97A 4xumB-3a14A:
undetectable		 4xumB-3a14A:
24.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 GLY A 284
ARG A 288
SER A 289
ALA A 292
ILE A 326
MET A 329
LEU A 330
LEU A 333
ILE A 341
MET A 348
 MC5  A   1 ( 4.5A)
None
MC5  A   1 (-2.6A)
None
MC5  A   1 ( 4.9A)
None
MC5  A   1 (-4.4A)
None
MC5  A   1 (-4.5A)
MC5  A   1 ( 4.0A)
 0.55A 4xumB-3b0qA:
36.3		 4xumB-3b0qA:
98.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b0q PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 GLY A 284
CYH A 285
ARG A 288
ALA A 292
MET A 329
LEU A 330
LEU A 333
 MC5  A   1 ( 4.5A)
MC5  A   1 (-3.6A)
None
None
None
MC5  A   1 (-4.4A)
None
 0.86A 4xumB-3b0qA:
36.3		 4xumB-3b0qA:
98.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		10 GLY D 284
CYH D 285
SER D 289
ALA D 292
ILE D 326
MET D 329
LEU D 330
LEU D 333
ILE D 341
MET D 348
 PLB  D 701 (-3.3A)
PLB  D 701 (-3.2A)
PLB  D 701 ( 3.9A)
PLB  D 701 ( 4.1A)
PLB  D 701 ( 4.5A)
None
PLB  D 701 ( 4.1A)
PLB  D 701 (-4.4A)
PLB  D 701 (-3.6A)
PLB  D 701 ( 4.7A)
 0.53A 4xumB-3dzuD:
34.1		 4xumB-3dzuD:
91.45
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.
3e0x LIPASE-ESTERASE
RELATED PROTEIN

(Clostridium
acetobutylicum) 		PF12146
(Hydrolase_4) 		5 GLY A  62
LEU A 177
LEU A  96
ILE A  94
MET A  90
 None
 1.18A 4xumB-3e0xA:
undetectable		 4xumB-3e0xA:
24.42
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.
3e60 3-OXOACYL-[ACYL-CARR
IER-PROTEIN ]
SYNTHASE II

(Bartonella
henselae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 267
ALA A 263
ILE A   6
LEU A 251
MET A   1
 None
 0.90A 4xumB-3e60A:
undetectable		 4xumB-3e60A:
22.93
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.
3fbg PUTATIVE ARGINATE
LYASE

(Staphylococcus
haemolyticus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  89
SER A  96
ALA A  98
ILE A  37
LEU A  34
 None
 1.19A 4xumB-3fbgA:
undetectable		 4xumB-3fbgA:
23.18
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.
3fy3 HEMOLYSIN

(Proteus
mirabilis) 		PF05860
(Haemagg_act) 		5 GLY A 205
ALA A 209
ILE A 212
LEU A 196
LEU A 157
 None
 0.99A 4xumB-3fy3A:
undetectable		 4xumB-3fy3A:
22.37
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.
3gfm 146AA LONG
HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR

(Sulfurisphaera
tokodaii) 		PF13463
(HTH_27) 		5 SER A  70
ILE A  67
MET A  53
LEU A  56
ILE A  96
 None
 1.12A 4xumB-3gfmA:
undetectable		 4xumB-3gfmA:
21.30
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.
3i9w SENSOR PROTEIN TORS

(Escherichia
coli) 		no annotation 5 SER A  49
ALA A  48
ILE A  82
LEU A  86
LEU A  89
 None
 1.15A 4xumB-3i9wA:
undetectable		 4xumB-3i9wA:
25.47
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.
3iml S-ADENOSYLMETHIONINE
SYNTHETASE

(Burkholderia
pseudomallei) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 SER A 277
ALA A 281
ILE A 344
MET A 347
ILE A 354
 None
 1.19A 4xumB-3imlA:
undetectable		 4xumB-3imlA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3izy TRANSLATION
INITIATION FACTOR
IF-2, MITOCHONDRIAL

(Bos taurus) 		PF00009
(GTP_EFTU)
PF11987
(IF-2) 		5 GLY P 671
ILE P 653
LEU P 694
LEU P 676
ILE P 674
 None
 1.18A 4xumB-3izyP:
undetectable		 4xumB-3izyP:
20.30
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.
3n0w ABC BRANCHED CHAIN
AMINO ACID FAMILY
TRANSPORTER,
PERIPLASMIC LIGAND
BINDING PROTEIN

(Paraburkholderia
xenovorans) 		PF13458
(Peripla_BP_6) 		5 SER A 308
ALA A 309
LEU A 353
LEU A 347
ILE A 335
 None
 1.01A 4xumB-3n0wA:
undetectable		 4xumB-3n0wA:
22.19
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.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		5 GLY A 338
SER A 406
LEU A 351
LEU A 345
ILE A 335
 None
 1.06A 4xumB-3of7A:
undetectable		 4xumB-3of7A:
21.02
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.
3pzy MOG

(Mycobacterium
avium) 		PF00994
(MoCF_biosynth) 		5 GLY A 118
CYH A 117
ALA A 149
LEU A 142
ILE A  66
 None
 1.12A 4xumB-3pzyA:
undetectable		 4xumB-3pzyA:
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.
3qg5 RAD50

(Thermotoga
maritima) 		PF13476
(AAA_23)
PF13558
(SbcCD_C) 		5 GLY A 770
ALA A 764
ILE A 755
LEU A 779
ILE A 777
 None
 1.01A 4xumB-3qg5A:
undetectable		 4xumB-3qg5A:
22.64
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.
3slk POLYKETIDE SYNTHASE
EXTENDER MODULE 2

(Saccharopolyspora
spinosa) 		PF08240
(ADH_N)
PF08659
(KR)
PF13602
(ADH_zinc_N_2) 		5 GLY A 251
ILE A 453
MET A 456
LEU A 457
LEU A 460
 None
 0.95A 4xumB-3slkA:
undetectable		 4xumB-3slkA:
16.17
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.
3tat TYROSINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 GLY A 197
ALA A 390
ILE A 330
MET A 333
LEU A 337
 None
 1.06A 4xumB-3tatA:
undetectable		 4xumB-3tatA:
20.67
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.
3u7b ENDO-1,4-BETA-XYLANA
SE

(Fusarium
oxysporum) 		PF00331
(Glyco_hydro_10) 		5 GLY A 271
ALA A 263
LEU A 306
ILE A 324
MET A   9
 None
 1.16A 4xumB-3u7bA:
undetectable		 4xumB-3u7bA:
23.18
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.
3w77 FMN-DEPENDENT
NADH-AZOREDUCTASE

(Bacillus sp.
B29) 		PF02525
(Flavodoxin_2) 		5 GLY A 145
ALA A  17
LEU A  22
LEU A 198
ILE A 193
 FMN  A 301 (-3.2A)
FMN  A 301 (-3.6A)
None
None
None
 1.03A 4xumB-3w77A:
undetectable		 4xumB-3w77A:
22.83
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.
3wmr PROLINE
IMINOPEPTIDASE

(Streptomyces
halstedii) 		PF00561
(Abhydrolase_1) 		5 GLY A 108
SER A 117
ALA A 120
ILE A 238
MET A 291
 None
 1.15A 4xumB-3wmrA:
undetectable		 4xumB-3wmrA:
23.81
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.
3zyo LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4B

(Mus musculus) 		PF00560
(LRR_1)
PF07679
(I-set)
PF13855
(LRR_8) 		5 GLY A 403
ILE A 415
LEU A 423
LEU A 385
MET A 439
 None
 1.17A 4xumB-3zyoA:
undetectable		 4xumB-3zyoA:
21.03
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.
4ads PDX2 PROTEIN

(Plasmodium
falciparum) 		PF01174
(SNO) 		5 GLY G  89
CYH G  90
SER G  94
ILE G 117
ILE G  83
 None
 1.10A 4xumB-4adsG:
undetectable		 4xumB-4adsG:
21.00
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.
4c4o CARBONYL REDUCTASE
CPCR2

(Candida
parapsilosis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 194
ALA A 215
ILE A 187
LEU A 176
LEU A 175
 None
 1.16A 4xumB-4c4oA:
undetectable		 4xumB-4c4oA:
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.
4c9b PRE-MRNA-SPLICING
FACTOR CWC22 HOMOLOG

(Homo sapiens) 		PF02854
(MIF4G) 		5 ALA B 261
MET B 277
LEU B 278
LEU B 281
ILE B 294
 None
 1.10A 4xumB-4c9bB:
undetectable		 4xumB-4c9bB:
23.38
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.
4ccw CARBOXYL ESTERASE NP

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		5 GLY A 132
ALA A 150
ILE A 237
LEU A 239
LEU A 240
 None
 1.03A 4xumB-4ccwA:
undetectable		 4xumB-4ccwA:
23.77
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.
4e4u MANDALATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(unidentified) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A  92
ALA A 100
LEU A   6
ILE A  24
MET A  50
 None
 1.16A 4xumB-4e4uA:
undetectable		 4xumB-4e4uA:
21.13
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		5 GLY L 249
ALA L 243
ILE L  79
LEU L 116
MET L 127
 None
 1.13A 4xumB-4heaL:
undetectable		 4xumB-4heaL:
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.
4hi0 UREASE ACCESSORY
PROTEIN UREG

(Helicobacter
pylori) 		PF02492
(cobW) 		5 GLY E  60
ALA E  70
ILE E  71
LEU E 112
MET E  85
 None
 1.08A 4xumB-4hi0E:
undetectable		 4xumB-4hi0E:
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 SER A 817
ALA A 816
LEU A 376
LEU A 375
ILE A 362
 None
 1.11A 4xumB-4hsuA:
undetectable		 4xumB-4hsuA:
18.38
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.
4i1i MALATE DEHYDROGENASE

(Leishmania
major) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  87
ALA A  76
LEU A  49
LEU A  46
ILE A  42
 NAD  A 400 (-3.2A)
None
None
EDO  A 402 (-4.2A)
NAD  A 400 (-3.8A)
 0.98A 4xumB-4i1iA:
undetectable		 4xumB-4i1iA:
21.14
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.
4lsm GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE,
CYTOSOLIC

(Trypanosoma
cruzi) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 GLY A 304
ALA A 251
ILE A 168
LEU A 164
LEU A 161
 None
 0.96A 4xumB-4lsmA:
undetectable		 4xumB-4lsmA:
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.
4lx3 DNA POLYMERASE III,
ALPHA SUBUNIT
NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE

(Nostoc
punctiforme) 		no annotation 5 GLY A  19
SER A   3
ALA A  68
LEU B  28
ILE B  18
 None
 1.19A 4xumB-4lx3A:
undetectable		 4xumB-4lx3A:
18.45
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.
4m5p NADPH DEHYDROGENASE

(Scheffersomyces
stipitis) 		PF00724
(Oxidored_FMN) 		5 GLY A 320
SER A 323
ALA A 326
LEU A 359
LEU A   9
 FMN  A 501 ( 3.7A)
None
None
None
None
 1.14A 4xumB-4m5pA:
undetectable		 4xumB-4m5pA:
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.
4mi2 PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 GLY A 125
ALA A  47
ILE A  21
LEU A  40
LEU A  41
 None
 1.19A 4xumB-4mi2A:
undetectable		 4xumB-4mi2A:
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.
4nek ENOYL-COA
HYDRATASE/CARNITHINE
RACEMASE

(Magnetospirillum
magneticum) 		PF00378
(ECH_1) 		5 GLY A 100
ALA A 167
ILE A 173
LEU A 110
ILE A 103
 None
 1.19A 4xumB-4nekA:
undetectable		 4xumB-4nekA:
24.12
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.
4oo0 MAF-LIKE PROTEIN
BCAL2394

(Burkholderia
cenocepacia) 		PF02545
(Maf) 		5 GLY A 180
MET A 116
LEU A 117
LEU A 120
ILE A 186
 None
 0.97A 4xumB-4oo0A:
undetectable		 4xumB-4oo0A:
19.86
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.
4pel PENICILLIN G ACYLASE
SUBUNIT ALPHA
PENICILLIN G ACYLASE
SUBUNIT BETA

(Kluyvera
cryocrescens) 		PF01804
(Penicil_amidase) 		5 GLY A  95
ALA A  21
ILE A  19
LEU B  37
ILE A  92
 None
 1.11A 4xumB-4pelA:
undetectable		 4xumB-4pelA:
22.38
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.
4px9 ATP-DEPENDENT RNA
HELICASE DDX3X

(Homo sapiens) 		PF00270
(DEAD) 		5 CYH A 223
SER A 382
ALA A 349
ILE A 389
LEU A 397
 None
 0.92A 4xumB-4px9A:
undetectable		 4xumB-4px9A:
22.87
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.
4qax 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Staphylococcus
aureus) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 GLY A 177
ALA A 216
ILE A 164
LEU A 117
ILE A 113
 None
 1.09A 4xumB-4qaxA:
undetectable		 4xumB-4qaxA:
21.55
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.
4w8p TALIN-1

(Mus musculus) 		no annotation 5 GLY A1482
ALA A1495
ILE A1543
LEU A1539
LEU A1565
 None
 1.18A 4xumB-4w8pA:
undetectable		 4xumB-4w8pA:
21.86
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.
4x9x DEGV
DOMAIN-CONTAINING
PROTEIN MW1315

(Staphylococcus
aureus) 		PF02645
(DegV) 		5 GLY A 268
ILE A 171
LEU A 195
LEU A  92
ILE A 263
 None
None
OLA  A 301 ( 3.9A)
OLA  A 301 (-3.6A)
OLA  A 301 ( 3.7A)
 1.17A 4xumB-4x9xA:
undetectable		 4xumB-4x9xA:
23.48
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.
4xpm PROTEIN MEH1
UNCHARACTERIZED
PROTEIN YCR075W-A

(Saccharomyces
cerevisiae) 		PF11503
(DUF3215)
no annotation 		5 GLY B  26
ALA B  14
ILE A 164
LEU A 160
LEU A 157
 None
 0.79A 4xumB-4xpmB:
undetectable		 4xumB-4xpmB:
16.75
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.
5c7m E3 UBIQUITIN-PROTEIN
LIGASE ITCHY HOMOLOG

(Homo sapiens) 		PF00632
(HECT) 		5 GLY A 784
CYH A 783
ALA A 648
ILE A 645
LEU A 770
 None
 0.99A 4xumB-5c7mA:
undetectable		 4xumB-5c7mA:
20.73
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.
5ci7 SERINE/THREONINE-PRO
TEIN KINASE ULK1

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 133
ALA A 125
ILE A  75
LEU A 139
ILE A 135
 None
 1.12A 4xumB-5ci7A:
undetectable		 4xumB-5ci7A:
23.96
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.
5e7j ATP-DEPENDENT RNA
HELICASE DDX3X

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 CYH A 223
SER A 382
ALA A 349
ILE A 389
LEU A 397
 None
 0.95A 4xumB-5e7jA:
undetectable		 4xumB-5e7jA:
19.91
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.
5gnd PUTATIVE SERINE
PROTEASE HHOA

(Synechocystis
sp. PCC 6803) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 GLY A 114
ALA A 271
ILE A 268
LEU A 176
ILE A 116
 None
 1.14A 4xumB-5gndA:
undetectable		 4xumB-5gndA:
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.
5ikb GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4,GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4

(Rattus
norvegicus) 		PF10613
(Lig_chan-Glu_bd) 		5 GLY A 219
SER A 102
ILE A 234
LEU A  43
LEU A  47
 None
 1.18A 4xumB-5ikbA:
undetectable		 4xumB-5ikbA:
21.74
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.
5j2s KILLER CELL
LECTIN-LIKE RECEPTOR
SUBFAMILY B MEMBER
1B ALLELE A

(Rattus
norvegicus) 		no annotation 5 ALA A 190
ILE A 154
LEU A 129
LEU A 119
ILE A 113
 None
 1.14A 4xumB-5j2sA:
undetectable		 4xumB-5j2sA:
19.78
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.
5jzx UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 GLY A 129
ALA A 100
ILE A  91
LEU A 121
ILE A 127
 FAD  A 401 (-3.4A)
None
None
None
FAD  A 401 (-4.1A)
 1.16A 4xumB-5jzxA:
undetectable		 4xumB-5jzxA:
21.41
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.
5l3r CELL DIVISION
PROTEIN FTSY
HOMOLOG,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 GLY B 327
ALA B 103
ILE B  81
LEU B 140
ILE B 113
 None
 0.95A 4xumB-5l3rB:
undetectable		 4xumB-5l3rB:
22.65
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.
5ndx GLYCOSYL HYDROLASE

(Rhizobium
leguminosarum) 		no annotation 5 GLY A  26
SER A 312
ILE A 288
ILE A  45
MET A  41
 None
 1.15A 4xumB-5ndxA:
undetectable		 4xumB-5ndxA:
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.
5o9h C5A ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1

(Homo sapiens) 		no annotation 5 SER A 283
ALA A  40
ILE A  96
LEU A  92
LEU A  89
 None
 1.03A 4xumB-5o9hA:
undetectable		 4xumB-5o9hA:
14.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5sz8 HEMOLYSIN

(Proteus
mirabilis) 		PF05860
(Haemagg_act) 		5 GLY A 205
ALA A 209
ILE A 212
LEU A 196
LEU A 157
 None
 0.95A 4xumB-5sz8A:
undetectable		 4xumB-5sz8A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t8t S-ADENOSYLMETHIONINE
SYNTHASE

(Neisseria
gonorrhoeae) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 SER A 278
ALA A 282
ILE A 345
MET A 348
ILE A 355
 None
 1.19A 4xumB-5t8tA:
undetectable		 4xumB-5t8tA:
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.
5tj7 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00397
(WW)
PF00632
(HECT) 		5 GLY A 751
CYH A 750
ALA A 615
ILE A 612
LEU A 737
 None
 1.00A 4xumB-5tj7A:
undetectable		 4xumB-5tj7A:
20.09
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.
5ucy TUBULIN ALPHA CHAIN

(Tetrahymena
thermophila) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 GLY A  17
ILE A 171
MET A 203
LEU A 204
ILE A 235
 None
 1.01A 4xumB-5ucyA:
undetectable		 4xumB-5ucyA:
19.41
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.
5ufh LACI-TYPE
TRANSCRIPTIONAL
REGULATOR

(Bifidobacterium
animalis) 		PF13377
(Peripla_BP_3) 		5 GLY A 188
SER A 228
ALA A 240
LEU A 257
MET A 211
 None
 0.82A 4xumB-5ufhA:
undetectable		 4xumB-5ufhA:
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.
5uuo GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN

(Novosphingobium
aromaticivorans) 		no annotation 5 GLY B 164
ALA B 228
ILE B 223
LEU B 236
ILE B 180
 None
 1.08A 4xumB-5uuoB:
undetectable		 4xumB-5uuoB:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v3e TRANSCRIPTIONAL
REGULATOR

(Porphyromonas
gingivalis) 		no annotation 5 GLY A  15
ARG A  84
ILE A 139
LEU A  86
ILE A  57
 None
GOL  A 201 ( 4.9A)
None
GOL  A 201 ( 4.9A)
None
 1.10A 4xumB-5v3eA:
undetectable		 4xumB-5v3eA:
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.
5v52 T-CELL
IMMUNORECEPTOR WITH
IG AND ITIM DOMAINS

(Homo sapiens) 		PF07686
(V-set) 		5 GLY A  90
ALA A  67
ILE A  77
LEU A  95
ILE A  42
 None
 0.84A 4xumB-5v52A:
undetectable		 4xumB-5v52A:
16.55
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.
5w8p HOMOSERINE
O-ACETYLTRANSFERASE

(Mycobacteroides
abscessus) 		PF00561
(Abhydrolase_1) 		5 GLY A 114
ALA A 140
ILE A  28
LEU A  30
ILE A 291
 GOL  A 407 ( 4.4A)
None
None
None
None
 0.96A 4xumB-5w8pA:
undetectable		 4xumB-5w8pA:
21.88
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.
5wuf PUTATIVE MEMBRANE
PROTEIN

(Colwellia
psychrerythraea) 		PF03458
(UPF0126) 		6 GLY A  33
SER A  39
ALA A  17
ILE A  69
LEU A  70
ILE A  77
 CD  A 301 ( 4.2A)
None
None
None
None
None
 1.41A 4xumB-5wufA:
undetectable		 4xumB-5wufA:
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.
5x5y PROBABLE ATP-BINDING
COMPONENT OF ABC
TRANSPORTER

(Pseudomonas
aeruginosa) 		no annotation 5 GLY B  79
SER B 154
ALA B 153
ILE B 102
LEU B  83
 None
 1.17A 4xumB-5x5yB:
undetectable		 4xumB-5x5yB:
23.91
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.
5xsy SODIUM CHANNEL
PROTEIN

(Electrophorus
electricus) 		PF00520
(Ion_trans)
PF06512
(Na_trans_assoc) 		5 GLY A 242
ILE A 775
LEU A 779
LEU A 782
MET A 403
 None
 1.06A 4xumB-5xsyA:
undetectable		 4xumB-5xsyA:
9.65
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.
6aph ADENOSYLHOMOCYSTEINA
SE

(Elizabethkingia
anophelis) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 CYH A 302
ALA A 211
ILE A 208
ILE A 341
MET A 295
 None
 1.11A 4xumB-6aphA:
undetectable		 4xumB-6aphA:
20.66
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.
6c1q SOLUBLE CYTOCHROME
B562, C5A
ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1 CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 5 SER B 369
ALA B 126
ILE B 182
LEU B 178
LEU B 175
 None
 1.00A 4xumB-6c1qB:
undetectable		 4xumB-6c1qB:
12.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6et0 PQSB

(Pseudomonas
aeruginosa) 		no annotation 5 GLY B  61
ALA B  93
ILE B  56
LEU B  88
ILE B  80
 None
 1.13A 4xumB-6et0B:
undetectable		 4xumB-6et0B:
14.81
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.
6ftl RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Skeletonema
marinoi) 		no annotation 5 GLY A  63
ALA A 103
ILE A  46
LEU A 137
LEU A 139
 None
 1.00A 4xumB-6ftlA:
undetectable		 4xumB-6ftlA:
14.91