SIMILAR PATTERNS OF AMINO ACIDS FOR 2GL0_C_ADNC903

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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 ILE C 214
ALA C 184
VAL C 421
PHE C 491
SER C 509
 None
 1.37A 2gl0A-1a5lC:
0.0
2gl0C-1a5lC:
undetectable		 2gl0A-1a5lC:
15.58
2gl0C-1a5lC:
15.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1arl APO-CARBOXYPEPTIDASE
A=ALPHA= (COX)

(Bos taurus) 		PF00246
(Peptidase_M14) 		5 ALA A 143
ASN A 144
VAL A  49
SER A 254
HIS A 196
 None
 0.99A 2gl0A-1arlA:
0.0
2gl0C-1arlA:
0.0		 2gl0A-1arlA:
16.39
2gl0C-1arlA:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fy2 ASPARTYL DIPEPTIDASE

(Salmonella
enterica) 		PF03575
(Peptidase_S51) 		5 ILE A 154
THR A 129
ALA A 146
VAL A 198
PHE A 150
 None
 1.43A 2gl0A-1fy2A:
0.0
2gl0C-1fy2A:
0.0		 2gl0A-1fy2A:
24.03
2gl0C-1fy2A:
24.03
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT ALPHA

(Desulfovibrio
gigas) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 ILE A 337
ALA A 385
ASN A 382
VAL A 351
PHE A 244
 None
 1.09A 2gl0A-1h0hA:
undetectable
2gl0C-1h0hA:
undetectable		 2gl0A-1h0hA:
11.00
2gl0C-1h0hA:
11.00
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.
1je5 HELIX-DESTABILIZING
PROTEIN

(Escherichia
virus T7) 		no annotation 5 ASN A  46
THR A 103
ASN A  99
VAL A  59
PHE A  96
 None
 1.50A 2gl0A-1je5A:
0.0
2gl0C-1je5A:
0.0		 2gl0A-1je5A:
20.57
2gl0C-1je5A:
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.
1m6s L-ALLO-THREONINE
ALDOLASE

(Thermotoga
maritima) 		PF01212
(Beta_elim_lyase) 		5 ASN A 136
THR A 137
ALA A 175
ASN A 174
VAL A 210
 None
 1.28A 2gl0A-1m6sA:
0.0
2gl0C-1m6sA:
1.0		 2gl0A-1m6sA:
21.33
2gl0C-1m6sA:
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.
1mi5 TCR ALPHA CHAIN
TCR BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		5 ALA E 240
VAL E 199
HIS E 210
PHE E 211
SER D 131
 None
 1.36A 2gl0A-1mi5E:
0.0
2gl0C-1mi5E:
0.2		 2gl0A-1mi5E:
23.39
2gl0C-1mi5E:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1miu BREAST CANCER TYPE 2
SUSCEPTIBILITY
PROTEIN

(Mus musculus) 		PF09103
(BRCA-2_OB1)
PF09104
(BRCA-2_OB3)
PF09121
(Tower)
PF09169
(BRCA-2_helical) 		5 ILE A2672
THR A2643
ALA A2648
VAL A2661
SER A2475
 None
 1.16A 2gl0A-1miuA:
undetectable
2gl0C-1miuA:
undetectable		 2gl0A-1miuA:
12.02
2gl0C-1miuA:
12.02
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.
1nsv GALACTOSE MUTAROTASE

(Lactococcus
lactis) 		PF01263
(Aldose_epim) 		5 ILE A 153
ALA A  69
ASN A 166
VAL A 269
TYR A 334
 None
 1.41A 2gl0A-1nsvA:
undetectable
2gl0C-1nsvA:
undetectable		 2gl0A-1nsvA:
18.02
2gl0C-1nsvA:
18.02
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.
1pg5 ASPARTATE
CARBAMOYLTRANSFERASE

(Sulfolobus
acidocaldarius) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ASN A 165
THR A 163
ALA A 161
VAL A 201
TYR A 199
 None
 1.48A 2gl0A-1pg5A:
undetectable
2gl0C-1pg5A:
undetectable		 2gl0A-1pg5A:
20.40
2gl0C-1pg5A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1slq VP4

(Rotavirus A) 		PF17477
(Rota_VP4_MID)
PF17478
(VP4_helical) 		5 ILE A 273
THR A 317
ALA A 299
ASN A 300
HIS A 315
 None
 1.46A 2gl0A-1slqA:
undetectable
2gl0C-1slqA:
undetectable		 2gl0A-1slqA:
18.35
2gl0C-1slqA:
18.35
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.
1srd COPPER,ZINC
SUPEROXIDE DISMUTASE

(Spinacia
oleracea) 		PF00080
(Sod_Cu) 		5 ILE A  87
ALA A 145
VAL A  31
PHE A  45
HIS A 120
 None
None
None
None
CU  A 155 (-3.0A)
 1.26A 2gl0A-1srdA:
undetectable
2gl0C-1srdA:
undetectable		 2gl0A-1srdA:
23.43
2gl0C-1srdA:
23.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vgg CONSERVED
HYPOTHETICAL PROTEIN
TT1634 (TTHA1091)

(Thermus
thermophilus) 		PF04008
(Adenosine_kin) 		6 ASN A  15
ILE A  93
THR A 112
ALA A 113
ASN A 114
TYR A 159
 None
 0.49A 2gl0A-1vggA:
25.8
2gl0C-1vggA:
26.2		 2gl0A-1vggA:
57.65
2gl0C-1vggA:
57.65
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.
1xp4 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Streptococcus
pneumoniae) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 ASN A 158
ILE A  54
THR A 160
ASN A 121
SER A  97
 None
None
None
None
SO4  A 464 ( 3.9A)
 1.28A 2gl0A-1xp4A:
undetectable
2gl0C-1xp4A:
undetectable		 2gl0A-1xp4A:
21.00
2gl0C-1xp4A:
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.
1z3q THAUMATIN-LIKE
PROTEIN

(Musa acuminata) 		PF00314
(Thaumatin) 		5 ILE A  44
THR A   2
ALA A   1
ASN A 193
SER A 113
 None
 1.35A 2gl0A-1z3qA:
undetectable
2gl0C-1z3qA:
undetectable		 2gl0A-1z3qA:
20.00
2gl0C-1z3qA:
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.
1z45 GAL10 BIFUNCTIONAL
PROTEIN

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim)
PF16363
(GDP_Man_Dehyd) 		5 ILE A 518
ALA A 431
ASN A 533
VAL A 637
TYR A 696
 None
 1.45A 2gl0A-1z45A:
undetectable
2gl0C-1z45A:
undetectable		 2gl0A-1z45A:
16.70
2gl0C-1z45A:
16.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ekm HYPOTHETICAL PROTEIN
ST1511

(Sulfurisphaera
tokodaii) 		PF04008
(Adenosine_kin) 		6 ASN A  17
ILE A  94
THR A 113
ALA A 114
ASN A 115
TYR A 160
 None
 0.35A 2gl0A-2ekmA:
27.6
2gl0C-2ekmA:
27.8		 2gl0A-2ekmA:
66.47
2gl0C-2ekmA:
66.47
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 ILE A 133
ALA A 151
VAL A 195
PHE A 135
HIS A 140
 None
 1.03A 2gl0A-2eo5A:
undetectable
2gl0C-2eo5A:
undetectable		 2gl0A-2eo5A:
20.48
2gl0C-2eo5A:
20.48
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 THR A 150
ALA A 151
VAL A 195
PHE A 135
HIS A 140
 None
 1.28A 2gl0A-2eo5A:
undetectable
2gl0C-2eo5A:
undetectable		 2gl0A-2eo5A:
20.48
2gl0C-2eo5A:
20.48
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.
2g28 PYRUVATE
DEHYDROGENASE E1
COMPONENT

(Escherichia
coli) 		PF00456
(Transketolase_N) 		5 ILE A 391
THR A 115
ALA A 114
HIS A 364
SER A  83
 None
 1.40A 2gl0A-2g28A:
undetectable
2gl0C-2g28A:
undetectable		 2gl0A-2g28A:
11.61
2gl0C-2g28A:
11.61
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.
2h4t CARNITINE
O-PALMITOYLTRANSFERA
SE II, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00755
(Carn_acyltransf) 		5 ILE A 612
ALA A 505
TYR A 614
PHE A 471
SER A 513
 None
 1.35A 2gl0A-2h4tA:
undetectable
2gl0C-2h4tA:
0.6		 2gl0A-2h4tA:
15.97
2gl0C-2h4tA:
15.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2jb7 HYPOTHETICAL PROTEIN
PAE2307

(Pyrobaculum
aerophilum) 		PF04008
(Adenosine_kin) 		8 ASN A  20
TRP A  95
ILE A  97
THR A 116
ALA A 117
ASN A 118
VAL A 163
TYR A 165
 AMP  A1168 (-3.4A)
AMP  A1168 ( 3.2A)
AMP  A1168 ( 4.5A)
AMP  A1168 ( 4.7A)
AMP  A1168 (-3.2A)
AMP  A1168 (-3.5A)
AMP  A1168 (-4.7A)
AMP  A1168 (-4.5A)
 0.24A 2gl0A-2jb7A:
29.6
2gl0C-2jb7A:
29.8		 2gl0A-2jb7A:
98.20
2gl0C-2jb7A:
98.20
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.
2q9u A-TYPE FLAVOPROTEIN

(Giardia
intestinalis) 		no annotation 5 ASN A  42
ILE A  22
ALA A 229
ASN A 170
VAL A  27
 None
 1.29A 2gl0A-2q9uA:
undetectable
2gl0C-2q9uA:
undetectable		 2gl0A-2q9uA:
15.68
2gl0C-2q9uA:
15.68
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.
2vlc TYPE 2
RIBOSOME-INACTIVATIN
G PROTEIN CINNAMOMIN
III

(Cinnamomum
camphora) 		PF00161
(RIP)
PF00652
(Ricin_B_lectin) 		5 ILE A  20
THR A  12
ALA A  11
VAL A  54
PHE A  19
 None
 1.48A 2gl0A-2vlcA:
undetectable
2gl0C-2vlcA:
undetectable		 2gl0A-2vlcA:
14.18
2gl0C-2vlcA:
14.18
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.
2w5f ENDO-1,4-BETA-XYLANA
SE Y

(Ruminiclostridium
thermocellum) 		PF00331
(Glyco_hydro_10)
PF02018
(CBM_4_9) 		5 ILE A 538
ALA A 476
VAL A 205
TYR A 199
PHE A 483
 None
 1.47A 2gl0A-2w5fA:
undetectable
2gl0C-2w5fA:
undetectable		 2gl0A-2w5fA:
14.88
2gl0C-2w5fA:
14.88
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.
3c60 TCR YAE62 ALPHA
CHAIN
TCR YAE62 BETA CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		5 ALA B 233
VAL B 192
HIS B 203
PHE B 204
SER A 126
 None
 1.35A 2gl0A-3c60B:
undetectable
2gl0C-3c60B:
undetectable		 2gl0A-3c60B:
20.54
2gl0C-3c60B:
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.
3cdi POLYNUCLEOTIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		5 ALA A 464
VAL A 410
HIS A 426
PHE A 405
SER A 452
 None
 1.45A 2gl0A-3cdiA:
1.7
2gl0C-3cdiA:
1.6		 2gl0A-3cdiA:
13.85
2gl0C-3cdiA:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gay FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Giardia
intestinalis) 		PF01116
(F_bP_aldolase) 		5 ILE A 241
ALA A  13
VAL A 254
PHE A 301
SER A  43
 None
None
P6T  A 327 (-4.3A)
None
None
 1.20A 2gl0A-3gayA:
undetectable
2gl0C-3gayA:
undetectable		 2gl0A-3gayA:
18.90
2gl0C-3gayA:
18.90
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.
3hgl EFFECTOR PROTEIN
HOPAB2

(Pseudomonas
syringae group
genomosp. 3) 		no annotation 5 ILE A  45
ALA A   6
HIS A  49
PHE A  46
SER A  62
 None
 1.33A 2gl0A-3hglA:
undetectable
2gl0C-3hglA:
undetectable		 2gl0A-3hglA:
19.08
2gl0C-3hglA:
19.08
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.
3i23 OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Enterococcus
faecalis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 ILE A  93
THR A  73
VAL A  22
TYR A 305
PHE A   7
 None
 1.44A 2gl0A-3i23A:
undetectable
2gl0C-3i23A:
undetectable		 2gl0A-3i23A:
21.49
2gl0C-3i23A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3if2 AMINOTRANSFERASE

(Psychrobacter
arcticus) 		PF00155
(Aminotran_1_2) 		5 ILE A 285
THR A 308
VAL A 319
PHE A  87
SER A  74
 None
 1.42A 2gl0A-3if2A:
undetectable
2gl0C-3if2A:
undetectable		 2gl0A-3if2A:
16.37
2gl0C-3if2A:
16.37
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.
3jr3 NAD-DEPENDENT
DEACETYLASE

(Thermotoga
maritima) 		PF02146
(SIR2) 		5 ILE A 185
THR A  97
ASN A  99
SER A  25
HIS A 104
 None
 1.24A 2gl0A-3jr3A:
undetectable
2gl0C-3jr3A:
undetectable		 2gl0A-3jr3A:
24.08
2gl0C-3jr3A:
24.08
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.
3lnp AMIDOHYDROLASE
FAMILY PROTEIN
OLEI01672_1_465

(Oleispira
antarctica) 		PF01979
(Amidohydro_1) 		5 ASN A 336
ASN A 306
VAL A 114
SER A 311
HIS A 280
 CA  A 472 (-2.9A)
None
None
None
None
 1.36A 2gl0A-3lnpA:
undetectable
2gl0C-3lnpA:
undetectable		 2gl0A-3lnpA:
16.09
2gl0C-3lnpA:
16.09
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.
3nv0 NUCLEAR RNA EXPORT
FACTOR 2

(Caenorhabditis
elegans) 		no annotation 5 ILE A 220
THR A 360
VAL A 365
PHE A 334
HIS A 337
 None
 1.41A 2gl0A-3nv0A:
undetectable
2gl0C-3nv0A:
undetectable		 2gl0A-3nv0A:
22.27
2gl0C-3nv0A:
22.27
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.
3q94 FRUCTOSE-BISPHOSPHAT
E ALDOLASE, CLASS II

(Bacillus
anthracis) 		PF01116
(F_bP_aldolase) 		5 ILE A 219
ALA A  13
VAL A 232
PHE A 279
SER A  43
 None
None
13P  A 321 (-3.7A)
None
None
 1.11A 2gl0A-3q94A:
undetectable
2gl0C-3q94A:
undetectable		 2gl0A-3q94A:
22.22
2gl0C-3q94A:
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.
3t38 ARSENATE REDUCTASE

(Corynebacterium
glutamicum) 		PF01451
(LMWPc) 		5 ILE A 194
ALA A  92
ASN A  91
VAL A 136
SER A 114
 None
 1.28A 2gl0A-3t38A:
undetectable
2gl0C-3t38A:
undetectable		 2gl0A-3t38A:
23.61
2gl0C-3t38A:
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.
3tpu 42F3 ALPHA
42F3 BETA

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		5 ALA B 234
VAL B 193
HIS B 204
PHE B 205
SER A 128
 None
None
SO4  B 243 (-3.9A)
None
None
 1.35A 2gl0A-3tpuB:
undetectable
2gl0C-3tpuB:
undetectable		 2gl0A-3tpuB:
20.52
2gl0C-3tpuB:
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.
3v4b STARVATION SENSING
PROTEIN RSPA

(Cellvibrio
japonicus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A  31
ALA A 354
TYR A  29
HIS A 370
HIS A 327
 None
 1.17A 2gl0A-3v4bA:
undetectable
2gl0C-3v4bA:
undetectable		 2gl0A-3v4bA:
16.67
2gl0C-3v4bA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4atw ALPHA-L-ARABINOFURAN
OSIDASE DOMAIN
PROTEIN

(Thermotoga
maritima) 		PF06964
(Alpha-L-AF_C) 		5 ILE A 479
THR A 470
VAL A 424
HIS A 469
PHE A 467
 None
 1.45A 2gl0A-4atwA:
undetectable
2gl0C-4atwA:
undetectable		 2gl0A-4atwA:
16.74
2gl0C-4atwA:
16.74
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.
4bpc RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 ILE A1462
THR A1486
ALA A1485
ASN A1578
TYR A1451
 None
 1.16A 2gl0A-4bpcA:
undetectable
2gl0C-4bpcA:
undetectable		 2gl0A-4bpcA:
14.41
2gl0C-4bpcA:
14.41
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.
4e3e MAOC DOMAIN PROTEIN
DEHYDRATASE

(Chloroflexus
aurantiacus) 		PF01575
(MaoC_dehydratas) 		5 ILE A 214
THR A 223
ASN A 228
HIS A 219
HIS A 233
 None
 1.42A 2gl0A-4e3eA:
undetectable
2gl0C-4e3eA:
undetectable		 2gl0A-4e3eA:
18.64
2gl0C-4e3eA:
18.64
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.
4en2 AP-1 COMPLEX SUBUNIT
MU-1

(Mus musculus) 		no annotation 5 ILE M 277
THR M 306
VAL M 179
TYR M 418
PHE M 380
 None
 1.29A 2gl0A-4en2M:
undetectable
2gl0C-4en2M:
undetectable		 2gl0A-4en2M:
21.19
2gl0C-4en2M:
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.
4ezi UNCHARACTERIZED
PROTEIN

(Legionella
pneumophila) 		no annotation 5 ILE A 202
THR A 333
ALA A 334
TYR A 227
SER A 363
 None
 1.43A 2gl0A-4eziA:
0.7
2gl0C-4eziA:
undetectable		 2gl0A-4eziA:
18.41
2gl0C-4eziA:
18.41
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.
4gm6 PFKB FAMILY
CARBOHYDRATE KINASE

(Listeria grayi) 		PF00294
(PfkB) 		5 ILE A 138
ALA A  35
TYR A 182
PHE A 164
HIS A 132
 None
GOL  A 401 (-3.9A)
None
None
None
 1.45A 2gl0A-4gm6A:
undetectable
2gl0C-4gm6A:
undetectable		 2gl0A-4gm6A:
19.05
2gl0C-4gm6A:
19.05
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.
4imv RICIN

(Ricinus
communis) 		PF00161
(RIP) 		5 ILE A  25
THR A  17
ALA A  16
VAL A  60
PHE A  24
 None
 1.42A 2gl0A-4imvA:
undetectable
2gl0C-4imvA:
undetectable		 2gl0A-4imvA:
19.10
2gl0C-4imvA:
19.10
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.
4m29 BETA-XYLOSIDASE

(Caulobacter
vibrioides) 		PF01229
(Glyco_hydro_39) 		5 THR A 203
ALA A 207
ASN A 165
VAL A 233
HIS A 229
 None
 1.39A 2gl0A-4m29A:
undetectable
2gl0C-4m29A:
undetectable		 2gl0A-4m29A:
17.43
2gl0C-4m29A:
17.43
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.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		5 ILE B 329
THR B 278
ALA B 279
VAL B 338
HIS B 281
 None
 1.19A 2gl0A-4ol0B:
undetectable
2gl0C-4ol0B:
undetectable		 2gl0A-4ol0B:
12.43
2gl0C-4ol0B:
12.43
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.
4twi NAD-DEPENDENT
PROTEIN DEACYLASE 1

(Archaeoglobus
fulgidus) 		PF02146
(SIR2) 		5 ILE A 182
THR A  97
ASN A  99
SER A  24
HIS A 104
 None
 1.17A 2gl0A-4twiA:
undetectable
2gl0C-4twiA:
undetectable		 2gl0A-4twiA:
22.18
2gl0C-4twiA:
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.
4xhp PARM HYBRID FUSION
PROTEIN

(Bacillus
thuringiensis) 		no annotation 5 ILE A 747
THR A 742
VAL A 783
PHE A 746
SER A 738
 ADP  A 903 (-3.6A)
None
None
None
None
 1.50A 2gl0A-4xhpA:
undetectable
2gl0C-4xhpA:
undetectable		 2gl0A-4xhpA:
12.82
2gl0C-4xhpA:
12.82
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.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 ILE A 467
THR A 505
ALA A 459
SER A 426
HIS A 423
 None
 1.40A 2gl0A-4xiiA:
undetectable
2gl0C-4xiiA:
undetectable		 2gl0A-4xiiA:
16.12
2gl0C-4xiiA:
16.12
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.
4y0e PUTATIVE DIOXYGENASE

(Mycobacteroides
abscessus) 		PF02668
(TauD) 		5 THR A 105
ASN A 257
TYR A 181
SER A 117
HIS A 262
 None
None
None
None
FE  A 401 (-3.2A)
 1.26A 2gl0A-4y0eA:
undetectable
2gl0C-4y0eA:
undetectable		 2gl0A-4y0eA:
18.64
2gl0C-4y0eA:
18.64
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.
4y0e PUTATIVE DIOXYGENASE

(Mycobacteroides
abscessus) 		PF02668
(TauD) 		5 THR A 105
ASN A 257
VAL A  86
SER A 117
HIS A 262
 None
None
None
None
FE  A 401 (-3.2A)
 1.11A 2gl0A-4y0eA:
undetectable
2gl0C-4y0eA:
undetectable		 2gl0A-4y0eA:
18.64
2gl0C-4y0eA:
18.64
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.
4z9n AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Brucella ovis) 		PF00497
(SBP_bac_3) 		5 ASN A 284
ILE A 278
THR A 237
ASN A 240
VAL A 320
 None
 1.43A 2gl0A-4z9nA:
undetectable
2gl0C-4z9nA:
undetectable		 2gl0A-4z9nA:
22.36
2gl0C-4z9nA:
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.
4zoq INTRACELLULAR SERINE
PROTEASE

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		5 ILE I 196
ALA I 383
ASN I 235
VAL I 346
SER I 237
 None
 1.32A 2gl0A-4zoqI:
undetectable
2gl0C-4zoqI:
undetectable		 2gl0A-4zoqI:
18.70
2gl0C-4zoqI:
18.70
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.
5b71 COMPLEMENT C5 BETA
CHAIN
SKY59 FAB HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
no annotation 		5 VAL E  43
TYR E  46
HIS B 108
PHE E  50
SER B  56
 None
 1.34A 2gl0A-5b71E:
undetectable
2gl0C-5b71E:
undetectable		 2gl0A-5b71E:
21.30
2gl0C-5b71E:
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		5 ASN A1061
ALA A1064
VAL A 731
PHE A 763
HIS A 766
 None
 1.31A 2gl0A-5cjuA:
undetectable
2gl0C-5cjuA:
undetectable		 2gl0A-5cjuA:
10.33
2gl0C-5cjuA:
10.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ddz RICIN

(Ricinus
communis) 		PF00161
(RIP) 		5 ILE A  25
THR A  17
ALA A  16
VAL A  60
PHE A  24
 None
 1.45A 2gl0A-5ddzA:
undetectable
2gl0C-5ddzA:
undetectable		 2gl0A-5ddzA:
16.41
2gl0C-5ddzA:
16.41
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.
5g56 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		5 ASN A 439
ILE A 564
THR A 364
ALA A 363
PHE A 369
 None
 1.35A 2gl0A-5g56A:
undetectable
2gl0C-5g56A:
undetectable		 2gl0A-5g56A:
10.56
2gl0C-5g56A:
10.56
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.
5gzh ENDO-BETA-1,2-GLUCAN
ASE

(Chitinophaga
pinensis) 		PF10091
(Glycoamylase) 		5 TRP A 367
ILE A 375
THR A 347
ALA A 348
PHE A 381
 None
 1.42A 2gl0A-5gzhA:
undetectable
2gl0C-5gzhA:
undetectable		 2gl0A-5gzhA:
18.55
2gl0C-5gzhA:
18.55
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.
5jpq ES1

(Chaetomium
thermophilum) 		no annotation 5 ILE o 187
THR o 101
ALA o  36
PHE o 103
SER o  70
 None
 1.39A 2gl0A-5jpqo:
undetectable
2gl0C-5jpqo:
undetectable		 2gl0A-5jpqo:
22.14
2gl0C-5jpqo:
22.14
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.
5jta NEUTRAL TREHALASE

(Saccharomyces
cerevisiae) 		no annotation 5 TRP A 578
ILE A 635
THR A 572
TYR A 312
HIS A 477
 None
 1.39A 2gl0A-5jtaA:
undetectable
2gl0C-5jtaA:
undetectable		 2gl0A-5jtaA:
11.85
2gl0C-5jtaA:
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kyh IHO670

(Ignicoccus
hospitalis) 		no annotation 5 ASN A 239
ILE A 123
THR A 240
HIS A 241
SER A 108
 None
 1.49A 2gl0A-5kyhA:
undetectable
2gl0C-5kyhA:
undetectable		 2gl0A-5kyhA:
19.75
2gl0C-5kyhA:
19.75
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.
5ltv CHEMOTACTIC
TRANSDUCER PCTC

(Pseudomonas
aeruginosa) 		PF02743
(dCache_1) 		5 THR A 218
ALA A 220
VAL A 264
TYR A 196
PHE A 198
 None
 1.40A 2gl0A-5ltvA:
undetectable
2gl0C-5ltvA:
undetectable		 2gl0A-5ltvA:
21.74
2gl0C-5ltvA:
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.
5lun 2-OXOGLUTARATE-DEPEN
DENT
ETHYLENE/SUCCINATE-F
ORMING ENZYME

(Pseudomonas
savastanoi) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		5 ILE A 186
THR A 190
ASN A 220
HIS A 189
SER A 226
 ARG  A 403 (-4.7A)
None
None
FE  A 401 (-3.3A)
None
 1.43A 2gl0A-5lunA:
undetectable
2gl0C-5lunA:
undetectable		 2gl0A-5lunA:
20.40
2gl0C-5lunA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m86 TA1207

(Thermoplasma
acidophilum) 		no annotation 5 ILE A 227
THR A 231
ALA A 232
TYR A 216
PHE A 255
 None
 1.46A 2gl0A-5m86A:
undetectable
2gl0C-5m86A:
2.2		 2gl0A-5m86A:
20.66
2gl0C-5m86A:
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.
5uhk O-GLCNACASE
TIM-BARREL DOMAIN

(Homo sapiens) 		PF07555
(NAGidase) 		5 ASN A 321
ALA A 320
TYR A 286
HIS A 282
PHE A 292
 None
 1.48A 2gl0A-5uhkA:
undetectable
2gl0C-5uhkA:
undetectable		 2gl0A-5uhkA:
18.35
2gl0C-5uhkA:
18.35
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.
5vj7 OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 ILE A 275
THR A 304
ALA A 305
VAL A 292
PHE A 271
 None
FAD  A 503 (-2.0A)
None
None
None
 1.31A 2gl0A-5vj7A:
undetectable
2gl0C-5vj7A:
undetectable		 2gl0A-5vj7A:
18.49
2gl0C-5vj7A:
18.49
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.
5xbl CRISPR-ASSOCIATED
ENDONUCLEASE
CAS9/CSN1

(Streptococcus
pyogenes) 		PF13395
(HNH_4)
PF16592
(Cas9_REC)
PF16593
(Cas9-BH)
PF16595
(Cas9_PI) 		5 ILE A 186
ALA A 299
VAL A 206
PHE A 185
SER A 245
 None
 1.46A 2gl0A-5xblA:
undetectable
2gl0C-5xblA:
undetectable		 2gl0A-5xblA:
9.15
2gl0C-5xblA:
9.15
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.
6d6k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Acinetobacter
baumannii) 		no annotation 5 ALA A 443
VAL A 389
HIS A 405
PHE A 384
SER A 431
 None
 1.41A 2gl0A-6d6kA:
undetectable
2gl0C-6d6kA:
1.9		 2gl0A-6d6kA:
17.37
2gl0C-6d6kA:
17.37
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.
6exv DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB3

(Sus scrofa) 		no annotation 5 ASN C  55
TYR B 753
HIS C  60
PHE C  63
SER C  57
 None
 1.10A 2gl0A-6exvC:
undetectable
2gl0C-6exvC:
undetectable		 2gl0A-6exvC:
20.61
2gl0C-6exvC:
20.61