SIMILAR PATTERNS OF AMINO ACIDS FOR 4C9O_A_CAMA423_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.
1b0k PROTEIN (ACONITASE)

(Sus scrofa) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 ILE A  42
THR A 266
LEU A  64
LEU A 197
ILE A 237
 None
 1.04A 4c9oA-1b0kA:
0.0		 4c9oA-1b0kA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cf2 PROTEIN
(GLYCERALDEHYDE-3-PH
OSPHATE
DEHYDROGENASE)

(Methanothermus
fervidus) 		no annotation 5 ILE P 261
GLY P 144
THR P 148
ILE P 247
VAL P 246
 None
 1.00A 4c9oA-1cf2P:
undetectable		 4c9oA-1cf2P:
22.50
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.
1ck7 PROTEIN (GELATINASE
A)

(Homo sapiens) 		PF00040
(fn2)
PF00045
(Hemopexin)
PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		5 THR A  93
LEU A  70
LEU A  74
GLY A  87
ILE A  94
 None
 1.03A 4c9oA-1ck7A:
undetectable		 4c9oA-1ck7A:
19.66
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 ILE B 419
THR B 492
GLY B 214
ILE B 491
VAL B 513
 None
 1.06A 4c9oA-1e9yB:
undetectable		 4c9oA-1e9yB:
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.
1f07 COENZYME
F420-DEPENDENT
N5,N10-METHYLENETETR
AHYDROMETHANOPTERIN
REDUCTASE

(Methanothermobacter
thermautotrophicus) 		PF00296
(Bac_luciferase) 		5 LEU A  80
THR A  53
VAL A  20
ILE A  16
VAL A  17
 None
 0.98A 4c9oA-1f07A:
undetectable		 4c9oA-1f07A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f51 SPORULATION
INITIATION
PHOSPHOTRANSFERASE F

(Bacillus
subtilis) 		PF00072
(Response_reg) 		5 ILE E1272
GLY E1262
VAL E1251
ILE E1276
VAL E1278
 None
 1.03A 4c9oA-1f51E:
undetectable		 4c9oA-1f51E:
14.84
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.
1g0i INOSITOL
MONOPHOSPHATASE

(Methanocaldococcus
jannaschii) 		PF00459
(Inositol_P) 		5 ILE A  10
GLY A 111
VAL A  78
ILE A  80
VAL A  79
 None
 1.02A 4c9oA-1g0iA:
undetectable		 4c9oA-1g0iA:
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.
1ko7 HPR
KINASE/PHOSPHATASE

(Staphylococcus
xylosus) 		PF02603
(Hpr_kinase_N)
PF07475
(Hpr_kinase_C) 		5 ILE A 273
THR A 260
GLY A 151
VAL A 263
ILE A 261
 None
 0.93A 4c9oA-1ko7A:
undetectable		 4c9oA-1ko7A:
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.
1m1l SUPPRESSOR OF FUSED

(Homo sapiens) 		PF05076
(SUFU) 		6 ILE A  91
LEU A  98
GLY A  33
THR A 190
VAL A 188
VAL A 195
 None
 1.41A 4c9oA-1m1lA:
0.0		 4c9oA-1m1lA:
21.10
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.
1mhs PLASMA MEMBRANE
ATPASE

(Neurospora
crassa) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		5 ILE A 554
GLY A 648
THR A 647
VAL A 372
ILE A 374
 None
 0.98A 4c9oA-1mhsA:
undetectable		 4c9oA-1mhsA:
18.78
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.
1pie GALACTOKINASE

(Lactococcus
lactis) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 LEU A 163
LEU A 166
GLY A 167
THR A 170
ILE A 108
 None
 0.99A 4c9oA-1pieA:
undetectable		 4c9oA-1pieA:
24.29
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.
1ri3 MRNA CAPPING ENZYME

(Encephalitozoon
cuniculi) 		PF03291
(Pox_MCEL) 		5 LEU A  57
THR A  62
VAL A  68
ASP A  70
VAL A 136
 None
None
None
SAH  A 299 ( 4.9A)
None
 1.02A 4c9oA-1ri3A:
undetectable		 4c9oA-1ri3A:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1szp DNA REPAIR PROTEIN
RAD51

(Saccharomyces
cerevisiae) 		PF08423
(Rad51)
PF14520
(HHH_5) 		5 THR A 356
LEU A 167
LEU A 171
GLY A 174
VAL A 322
 None
 1.05A 4c9oA-1szpA:
undetectable		 4c9oA-1szpA:
24.31
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.
1t4b ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Escherichia
coli) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ILE A 288
LEU A 147
GLY A 146
VAL A 304
VAL A 329
 None
 1.00A 4c9oA-1t4bA:
undetectable		 4c9oA-1t4bA:
23.30
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.
1v6c ALKALINE SERINE
PROTEASE

(Pseudoalteromonas
sp. AS-11) 		PF00082
(Peptidase_S8)
PF02225
(PA) 		6 THR A 352
LEU A 257
LEU A 278
THR A 340
VAL A 231
VAL A 336
 None
 1.37A 4c9oA-1v6cA:
undetectable		 4c9oA-1v6cA:
19.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vkd CONSERVED
HYPOTHETICAL PROTEIN
TM1225

(Thermotoga
maritima) 		PF04041
(Glyco_hydro_130) 		5 ILE A 229
GLY A 225
VAL A 321
ILE A 317
VAL A 318
 None
 1.01A 4c9oA-1vkdA:
undetectable		 4c9oA-1vkdA:
21.66
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.
2cxi PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Pyrococcus
horikoshii) 		PF03483
(B3_4)
PF03484
(B5) 		5 ILE A 108
THR A 275
LEU A 247
VAL A  91
VAL A 266
 None
 1.06A 4c9oA-2cxiA:
undetectable		 4c9oA-2cxiA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d52 PENTAKETIDE CHROMONE
SYNTHASE

(Aloe
arborescens) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 LEU A 386
LEU A 362
GLY A 359
VAL A 201
ILE A 237
 None
 1.04A 4c9oA-2d52A:
undetectable		 4c9oA-2d52A:
21.81
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.
2dc1 L-ASPARTATE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF01958
(DUF108)
PF03447
(NAD_binding_3) 		5 ILE A 128
THR A 166
LEU A 115
GLY A 113
VAL A 163
 None
None
None
None
CIT  A1585 (-4.1A)
 1.02A 4c9oA-2dc1A:
undetectable		 4c9oA-2dc1A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dfu PROBABLE
2-HYDROXYHEPTA-2,4-D
IENE-1,7-DIOATE
ISOMERASE

(Thermus
thermophilus) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		5 ILE A 256
GLY A 115
THR A 187
VAL A 189
ASP A 240
 None
 0.99A 4c9oA-2dfuA:
undetectable		 4c9oA-2dfuA:
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.
2ego GENERAL RECEPTOR FOR
PHOSPHOINOSITIDES
1-ASSOCIATED
SCAFFOLD PROTEIN

(Rattus
norvegicus) 		PF00595
(PDZ) 		6 THR A 185
LEU A 101
GLY A 147
THR A 149
VAL A 134
ILE A 154
 None
 1.32A 4c9oA-2egoA:
undetectable		 4c9oA-2egoA:
14.64
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.
2hoe N-ACETYLGLUCOSAMINE
KINASE

(Thermotoga
maritima) 		PF00480
(ROK) 		5 ILE A 123
LEU A 171
LEU A 168
ILE A  80
VAL A  82
 None
 1.07A 4c9oA-2hoeA:
undetectable		 4c9oA-2hoeA:
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.
2hvq HYPOTHETICAL 37.6
KDA PROTEIN IN
GP24-HOC INTERGENIC
REGION

(Escherichia
virus T4) 		PF09414
(RNA_ligase) 		5 GLY A 287
THR A 289
VAL A 267
ILE A 271
VAL A 270
 None
 1.04A 4c9oA-2hvqA:
3.6		 4c9oA-2hvqA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hwy PROTEIN SMG5

(Homo sapiens) 		PF13638
(PIN_4) 		5 LEU A 895
LEU A 892
GLY A 891
THR A 887
ASP A 860
 None
 1.07A 4c9oA-2hwyA:
undetectable		 4c9oA-2hwyA:
19.28
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.
2jc4 EXODEOXYRIBONUCLEASE
III

(Neisseria
meningitidis) 		PF03372
(Exo_endo_phos) 		5 LEU A 143
LEU A 144
GLY A 145
VAL A  65
ILE A  67
 None
 1.05A 4c9oA-2jc4A:
undetectable		 4c9oA-2jc4A:
21.63
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.
2kyl MICROTUBULE-ASSOCIAT
ED
SERINE/THREONINE-PRO
TEIN KINASE 2

(Homo sapiens) 		PF00595
(PDZ) 		5 ILE A  80
THR A  91
GLY A  53
VAL A  40
ILE A  60
 None
 1.01A 4c9oA-2kylA:
undetectable		 4c9oA-2kylA:
15.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2m56 CAMPHOR
5-MONOOXYGENASE

(Pseudomonas
putida) 		PF00067
(p450) 		9 THR A 101
THR A 185
LEU A 244
GLY A 248
THR A 252
VAL A 295
ASP A 297
ILE A 395
VAL A 396
 HEM  A 501 (-2.9A)
None
HEM  A 501 (-4.5A)
HEM  A 501 (-3.9A)
HEM  A 501 (-3.4A)
HEM  A 501 (-4.6A)
HEM  A 501 (-2.8A)
None
None
 0.69A 4c9oA-2m56A:
57.8		 4c9oA-2m56A:
44.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 ILE A 314
LEU A 330
GLY A 304
ILE A 291
VAL A 290
 ILE  A 314 ( 0.4A)
LEU  A 330 ( 0.6A)
GLY  A 304 ( 0.0A)
ILE  A 291 ( 0.7A)
VAL  A 290 ( 0.6A)
 1.04A 4c9oA-2nvvA:
undetectable		 4c9oA-2nvvA:
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.
2qkx BIFUNCTIONAL PROTEIN
GLMU

(Mycobacterium
tuberculosis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 ILE A  78
LEU A  37
GLY A 113
THR A 111
VAL A   9
 None
 1.07A 4c9oA-2qkxA:
undetectable		 4c9oA-2qkxA:
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.
2qup BH1478 PROTEIN

(Bacillus
halodurans) 		PF03885
(DUF327) 		5 ILE A 141
GLY A  78
VAL A 108
ILE A 104
VAL A 105
 None
 0.95A 4c9oA-2qupA:
undetectable		 4c9oA-2qupA:
16.86
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.
2qz6 BETA-LACTAMASE

(Pseudomonas
fluorescens) 		PF00144
(Beta-lactamase) 		5 ILE A 224
THR A 187
THR A  72
LEU A 184
LEU A 182
 None
 0.92A 4c9oA-2qz6A:
undetectable		 4c9oA-2qz6A:
24.94
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.
2rq6 ATP SYNTHASE EPSILON
CHAIN

(Thermosynechococcus
elongatus) 		PF00401
(ATP-synt_DE)
PF02823
(ATP-synt_DE_N) 		6 ILE A  76
THR A  42
LEU A  24
LEU A  31
GLY A  32
VAL A  69
 None
 1.13A 4c9oA-2rq6A:
undetectable		 4c9oA-2rq6A:
15.12
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.
2rq7 ATP SYNTHASE EPSILON
CHAIN

(Spinacia
oleracea;
Thermosynechococcus
elongatus) 		PF00401
(ATP-synt_DE)
PF02823
(ATP-synt_DE_N) 		5 ILE A  76
THR A  42
LEU A  31
GLY A  32
VAL A  69
 None
 1.00A 4c9oA-2rq7A:
undetectable		 4c9oA-2rq7A:
14.01
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.
2xkr PUTATIVE CYTOCHROME
P450 142

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		5 ILE A  65
GLY A 231
THR A 234
VAL A 277
VAL A 381
 None
HEM  A1400 (-3.2A)
HEM  A1400 (-3.7A)
HEM  A1400 (-4.5A)
None
 0.83A 4c9oA-2xkrA:
44.3		 4c9oA-2xkrA:
26.51
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.
2xkr PUTATIVE CYTOCHROME
P450 142

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		5 ILE A  65
LEU A 226
THR A 234
VAL A 277
VAL A 381
 None
HEM  A1400 (-4.4A)
HEM  A1400 (-3.7A)
HEM  A1400 (-4.5A)
None
 0.67A 4c9oA-2xkrA:
44.3		 4c9oA-2xkrA:
26.51
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.
2xkr PUTATIVE CYTOCHROME
P450 142

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		5 LEU A 226
GLY A 230
THR A 234
VAL A 277
VAL A 381
 HEM  A1400 (-4.4A)
PG4  A1399 ( 3.2A)
HEM  A1400 (-3.7A)
HEM  A1400 (-4.5A)
None
 0.74A 4c9oA-2xkrA:
44.3		 4c9oA-2xkrA:
26.51
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.
2xzd DARPIN-3.4

(synthetic
construct) 		PF12796
(Ank_2) 		5 ILE G  95
THR G  22
LEU G  67
LEU G  66
THR G  49
 None
 1.06A 4c9oA-2xzdG:
undetectable		 4c9oA-2xzdG:
17.27
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.
3abi PUTATIVE
UNCHARACTERIZED
PROTEIN PH1688

(Pyrococcus
horikoshii) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 ILE A 158
THR A 159
LEU A 146
GLY A 144
THR A 224
 None
None
None
SO4  A2001 (-3.0A)
SO4  A2001 (-3.8A)
 0.95A 4c9oA-3abiA:
undetectable		 4c9oA-3abiA:
24.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3asa LL-DIAMINOPIMELATE
AMINOTRANSFERASE

(Chlamydia
trachomatis) 		PF00155
(Aminotran_1_2) 		5 TRP A 247
THR A 207
LEU A 292
LEU A 289
GLY A 288
 None
 0.77A 4c9oA-3asaA:
undetectable		 4c9oA-3asaA:
23.58
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.
3d4u CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		5 ILE A  22
GLY A  84
THR A  87
VAL A  33
VAL A  52
 None
 1.02A 4c9oA-3d4uA:
undetectable		 4c9oA-3d4uA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dj4 BIFUNCTIONAL PROTEIN
GLMU

(Mycobacterium
tuberculosis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		6 ILE A  78
LEU A  37
GLY A 113
THR A 111
VAL A   9
ILE A  53
 None
None
UD1  A4000 (-4.1A)
None
None
None
 1.14A 4c9oA-3dj4A:
undetectable		 4c9oA-3dj4A:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3epm THIAMINE
BIOSYNTHESIS PROTEIN
THIC

(Caulobacter
vibrioides) 		PF01964
(ThiC_Rad_SAM)
PF13667
(ThiC-associated) 		5 LEU A 393
LEU A 396
GLY A 397
THR A 400
VAL A 410
 None
 0.84A 4c9oA-3epmA:
undetectable		 4c9oA-3epmA:
22.03
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.
3fhh OUTER MEMBRANE HEME
RECEPTOR SHUA

(Shigella
dysenteriae) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ILE A 120
THR A  49
GLY A  65
THR A 530
ILE A  48
 None
 1.06A 4c9oA-3fhhA:
undetectable		 4c9oA-3fhhA:
20.63
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.
3i2t EPIDERMAL GROWTH
FACTOR RECEPTOR,
ISOFORM A

(Drosophila
melanogaster) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		5 ILE A 109
GLY A 121
VAL A 115
ILE A 139
VAL A 140
 None
 0.86A 4c9oA-3i2tA:
undetectable		 4c9oA-3i2tA:
19.42
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF10

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF16004
(EFTUD2) 		5 ILE B 699
THR B 692
GLY B 819
VAL B 776
ILE B 780
 None
 1.06A 4c9oA-3jb9B:
undetectable		 4c9oA-3jb9B:
19.39
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.
3lda DNA REPAIR PROTEIN
RAD51

(Saccharomyces
cerevisiae) 		PF08423
(Rad51)
PF14520
(HHH_5) 		5 THR A 356
LEU A 167
LEU A 171
GLY A 174
VAL A 322
 None
 1.07A 4c9oA-3ldaA:
undetectable		 4c9oA-3ldaA:
24.62
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.
3m8l CAPSID PROTEIN

(Feline
calicivirus) 		PF00915
(Calici_coat) 		5 ILE A 456
THR A 461
GLY A 536
VAL A 576
ILE A 437
 None
 1.07A 4c9oA-3m8lA:
undetectable		 4c9oA-3m8lA:
21.34
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.
3mpo PREDICTED HYDROLASE
OF THE HAD
SUPERFAMILY

(Lactobacillus
brevis) 		PF08282
(Hydrolase_3) 		5 THR A 216
LEU A 200
GLY A 198
THR A 225
ASP A   9
 None
 1.07A 4c9oA-3mpoA:
undetectable		 4c9oA-3mpoA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ngx BIFUNCTIONAL PROTEIN
FOLD

(Thermoplasma
acidophilum) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 ILE A 142
THR A 247
THR A 135
GLY A 222
VAL A 162
 None
 1.07A 4c9oA-3ngxA:
undetectable		 4c9oA-3ngxA:
22.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3oft CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		5 LEU A  87
GLY A 234
THR A 238
VAL A 281
VAL A 384
 HEM  A 417 (-4.1A)
HEM  A 417 (-4.0A)
HEM  A 417 (-3.6A)
HEM  A 417 ( 4.8A)
None
 1.07A 4c9oA-3oftA:
49.9		 4c9oA-3oftA:
35.14
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.
3osl CARBOXYPEPTIDASE B2

(Bos taurus) 		PF00246
(Peptidase_M14) 		6 ILE A 133
LEU A 192
GLY A 196
THR A 199
VAL A 144
VAL A 163
 None
 1.38A 4c9oA-3oslA:
undetectable		 4c9oA-3oslA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3peh ENDOPLASMIN HOMOLOG

(Plasmodium
falciparum) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		5 ILE A 228
GLY A 152
THR A 241
VAL A 206
ILE A 217
 None
IBD  A1001 (-3.9A)
IBD  A1001 (-3.6A)
None
None
 1.03A 4c9oA-3pehA:
undetectable		 4c9oA-3pehA:
21.32
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.
3pl1 PYRAZINAMIDASE/NICOT
INAMIDASE PNCA
(PZASE)

(Mycobacterium
tuberculosis) 		PF00857
(Isochorismatase) 		5 ILE A  90
LEU A 116
GLY A 105
THR A 142
VAL A 130
 None
 1.06A 4c9oA-3pl1A:
undetectable		 4c9oA-3pl1A:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pqs TRANSFERRIN-BINDING
PROTEIN

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 ILE A 389
THR A 384
GLY A 504
VAL A 429
VAL A 436
 None
 1.04A 4c9oA-3pqsA:
undetectable		 4c9oA-3pqsA:
21.94
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.
3pqu TRANSFERRIN BINDING
PROTEIN B

(Actinobacillus
suis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 THR A 433
GLY A 553
VAL A 478
ILE A 505
VAL A 485
 None
 1.07A 4c9oA-3pquA:
undetectable		 4c9oA-3pquA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tvi ASPARTOKINASE

(Clostridium
acetobutylicum) 		PF00696
(AA_kinase)
PF01842
(ACT) 		5 ILE A  25
THR A 265
LEU A  13
GLY A  10
ILE A  35
 None
 0.99A 4c9oA-3tviA:
undetectable		 4c9oA-3tviA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zby P450 HEME-THIOLATE
PROTEIN

(Mycolicibacterium
smegmatis) 		PF00067
(p450) 		5 ILE A  68
GLY A 234
THR A 237
VAL A 280
VAL A 383
 None
HEM  A1402 (-3.3A)
HEM  A1402 (-3.7A)
HEM  A1402 (-4.4A)
None
 0.76A 4c9oA-3zbyA:
41.8		 4c9oA-3zbyA:
28.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zby P450 HEME-THIOLATE
PROTEIN

(Mycolicibacterium
smegmatis) 		PF00067
(p450) 		5 ILE A  68
LEU A 229
THR A 237
VAL A 280
VAL A 383
 None
HEM  A1402 ( 4.6A)
HEM  A1402 (-3.7A)
HEM  A1402 (-4.4A)
None
 0.70A 4c9oA-3zbyA:
41.8		 4c9oA-3zbyA:
28.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zby P450 HEME-THIOLATE
PROTEIN

(Mycolicibacterium
smegmatis) 		PF00067
(p450) 		5 LEU A 229
GLY A 233
THR A 237
VAL A 280
VAL A 383
 HEM  A1402 ( 4.6A)
EDO  A1406 ( 3.4A)
HEM  A1402 (-3.7A)
HEM  A1402 (-4.4A)
None
 0.75A 4c9oA-3zbyA:
41.8		 4c9oA-3zbyA:
28.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zh2 L-LACTATE
DEHYDROGENASE

(Plasmodium
falciparum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 244
LEU A 281
GLY A 282
VAL A  75
ILE A 123
 None
 1.03A 4c9oA-3zh2A:
undetectable		 4c9oA-3zh2A:
20.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		12 ILE A  88
TRP A  89
THR A 103
THR A 187
LEU A 252
LEU A 255
GLY A 256
THR A 260
VAL A 303
ASP A 305
ILE A 403
VAL A 404
 HEM  A1418 ( 4.5A)
None
GOL  A1419 (-3.8A)
None
HEM  A1418 (-4.0A)
GOL  A1419 ( 4.9A)
HEM  A1418 (-3.8A)
HEM  A1418 (-3.6A)
GOL  A1419 (-3.9A)
HEM  A1418 (-2.7A)
None
GOL  A1419 (-3.5A)
 0.31A 4c9oA-4c9mA:
72.2		 4c9oA-4c9mA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4dxy CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		8 ILE A  86
THR A 101
LEU A 250
GLY A 254
THR A 258
VAL A 301
ILE A 401
VAL A 402
 None
HEM  A 501 ( 4.8A)
HEM  A 501 (-4.3A)
PEG  A 502 (-3.8A)
HEM  A 501 (-3.7A)
PEG  A 502 ( 4.5A)
None
None
 0.76A 4c9oA-4dxyA:
55.3		 4c9oA-4dxyA:
61.00
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.
4g41 MTA/SAH NUCLEOSIDASE

(Streptococcus
pyogenes) 		PF01048
(PNP_UDP_1) 		5 ILE A 128
LEU A 222
VAL A  91
ILE A 190
VAL A 192
 ILE  A 128 ( 0.6A)
LEU  A 222 ( 0.6A)
VAL  A  91 ( 0.6A)
ILE  A 190 ( 0.7A)
VAL  A 192 ( 0.6A)
 1.04A 4c9oA-4g41A:
undetectable		 4c9oA-4g41A:
19.81
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.
4ga6 PUTATIVE THYMIDINE
PHOSPHORYLASE

(Thermococcus
kodakarensis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 ILE A 122
THR A 246
LEU A 260
LEU A 129
ILE A  91
 None
 0.96A 4c9oA-4ga6A:
undetectable		 4c9oA-4ga6A:
23.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4had PROBABLE
OXIDOREDUCTASE
PROTEIN

(Rhizobium etli) 		PF01408
(GFO_IDH_MocA) 		5 THR A 184
LEU A 222
GLY A 150
VAL A 247
ILE A 245
 None
 1.03A 4c9oA-4hadA:
undetectable		 4c9oA-4hadA:
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.
4hyq PHOSPHOLIPASE A1

(Streptomyces
albidoflavus) 		PF13472
(Lipase_GDSL_2) 		5 ILE A  80
THR A  58
GLY A 119
ILE A 175
VAL A 174
 None
 0.96A 4c9oA-4hyqA:
undetectable		 4c9oA-4hyqA:
20.14
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.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		5 THR A 331
LEU A  99
LEU A 309
GLY A 308
VAL A 348
 None
 1.00A 4c9oA-4mfiA:
undetectable		 4c9oA-4mfiA:
23.54
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.
4n91 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Anaerococcus
prevotii) 		PF03480
(DctP) 		5 THR A 147
GLY A  48
VAL A  93
ASP A 242
VAL A 244
 None
None
None
GCU  A 401 ( 2.7A)
None
 0.90A 4c9oA-4n91A:
undetectable		 4c9oA-4n91A:
22.03
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.
4n9f TRANSCRIPTION
ELONGATION FACTOR B
POLYPEPTIDE 2

(Homo sapiens) 		no annotation 5 ILE X  30
LEU X  44
LEU X  77
GLY X  76
ILE X  34
 None
 1.01A 4c9oA-4n9fX:
undetectable		 4c9oA-4n9fX:
12.65
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.
4oh0 BETA-LACTAMASE
OXA-58

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		5 THR A  59
LEU A 274
GLY A 275
VAL A 238
VAL A 246
 None
 1.06A 4c9oA-4oh0A:
undetectable		 4c9oA-4oh0A:
22.88
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.
4p98 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Conexibacter
woesei) 		PF02608
(Bmp) 		6 ILE A 178
THR A 240
LEU A 229
GLY A 226
ASP A 147
ILE A 241
 None
 0.84A 4c9oA-4p98A:
undetectable		 4c9oA-4p98A:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p99 MPAFP_RII
TETRA-TANDEMER

(Marinomonas
primoryensis) 		no annotation 5 THR A 160
GLY A 136
VAL A 187
ASP A 147
VAL A 149
 None
None
None
CA  A 507 ( 4.9A)
None
 1.07A 4c9oA-4p99A:
undetectable		 4c9oA-4p99A:
23.08
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.
4q0m L-ASPARAGINASE

(Pyrococcus
furiosus) 		PF00710
(Asparaginase) 		5 ILE A 227
LEU A 207
GLY A 231
VAL A 284
ILE A 248
 None
 0.99A 4c9oA-4q0mA:
undetectable		 4c9oA-4q0mA:
23.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rae HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00155
(Aminotran_1_2) 		5 ILE A 365
LEU A 345
GLY A 343
ASP A 368
VAL A 370
 None
 0.78A 4c9oA-4raeA:
undetectable		 4c9oA-4raeA:
23.43
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.
4u39 CELL DIVISION
PROTEIN FTSZ

(Bacillus
subtilis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		6 ILE A 120
GLY A 112
THR A 109
VAL A  43
ILE A  17
VAL A  19
 None
None
PO4  A 401 (-4.1A)
None
None
None
 1.35A 4c9oA-4u39A:
undetectable		 4c9oA-4u39A:
24.25
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.
4y4n PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanotorris
igneus) 		PF01946
(Thi4) 		5 ILE A  27
GLY A  36
VAL A 146
ILE A 148
VAL A 133
 None
48H  A 302 (-3.2A)
None
None
48H  A 302 (-4.2A)
 1.00A 4c9oA-4y4nA:
undetectable		 4c9oA-4y4nA:
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.
4ysj CALMODULIN-LIKE
DOMAIN PROTEIN
KINASE

(Eimeria tenella) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		5 THR A 140
LEU A 285
LEU A 280
VAL A 210
ILE A 139
 None
 0.95A 4c9oA-4ysjA:
undetectable		 4c9oA-4ysjA:
23.58
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.
5bp7 SAM-DEPENDENT
METHYLTRANSFERASE

(Geobacter
sulfurreducens) 		PF13847
(Methyltransf_31) 		5 LEU A  26
LEU A  29
GLY A  30
ASP A  43
VAL A 107
 None
None
None
SAH  A 301 ( 4.5A)
None
 1.06A 4c9oA-5bp7A:
undetectable		 4c9oA-5bp7A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp7 SAM-DEPENDENT
METHYLTRANSFERASE

(Geobacter
sulfurreducens) 		PF13847
(Methyltransf_31) 		5 LEU A  26
LEU A  29
GLY A  30
VAL A  41
VAL A 107
 None
 0.68A 4c9oA-5bp7A:
undetectable		 4c9oA-5bp7A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5epe SAM-DEPENDENT
METHYLTRANSFERASE

(Thiobacillus
denitrificans) 		PF13847
(Methyltransf_31) 		5 LEU A  25
LEU A  28
GLY A  29
VAL A  40
VAL A 106
 None
 0.66A 4c9oA-5epeA:
undetectable		 4c9oA-5epeA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fis EXD1

(Bombyx mori) 		PF01612
(DNA_pol_A_exo1) 		5 ILE B 170
THR B 195
LEU B 221
GLY B 218
ILE B 258
 None
 1.03A 4c9oA-5fisB:
undetectable		 4c9oA-5fisB:
18.40
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.
5huc 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE (DAHP)
SYNTHASE

(Corynebacterium
glutamicum) 		PF01474
(DAHP_synth_2) 		5 ILE A 361
THR A 343
GLY A 417
ILE A 344
VAL A 345
 None
 0.99A 4c9oA-5hucA:
undetectable		 4c9oA-5hucA:
22.80
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.
5iy7 GENERAL
TRANSCRIPTION FACTOR
IIE SUBUNIT 1

(Homo sapiens) 		PF02002
(TFIIE_alpha)
PF08271
(TF_Zn_Ribbon) 		5 ILE Q  38
THR Q  98
LEU Q  66
VAL Q  21
ILE Q  22
 None
 1.06A 4c9oA-5iy7Q:
undetectable		 4c9oA-5iy7Q:
22.69
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.
5jxm PRIB

(Streptomyces
sp. RM-5-8) 		PF11991
(Trp_DMAT) 		5 THR A  91
LEU A  35
GLY A  36
VAL A 111
VAL A  93
 None
 0.79A 4c9oA-5jxmA:
undetectable		 4c9oA-5jxmA:
23.87
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.
5k1b WD REPEAT-CONTAINING
PROTEIN 48

(Homo sapiens) 		PF00400
(WD40)
PF11816
(DUF3337) 		6 ILE B 375
THR B 377
THR B 430
GLY B 427
ILE B 431
VAL B  20
 None
 1.33A 4c9oA-5k1bB:
undetectable		 4c9oA-5k1bB:
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.
5k1c WD REPEAT-CONTAINING
PROTEIN 48

(Homo sapiens) 		PF00400
(WD40) 		6 ILE B 375
THR B 377
THR B 430
GLY B 427
ILE B 431
VAL B  20
 None
 1.42A 4c9oA-5k1cB:
undetectable		 4c9oA-5k1cB:
22.88
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.
5k9x TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Legionella
pneumophila) 		PF00290
(Trp_syntA) 		5 THR A  33
LEU A  99
LEU A  50
GLY A  51
ASP A  80
 None
 1.04A 4c9oA-5k9xA:
undetectable		 4c9oA-5k9xA:
21.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kyo CYP101J2

(Sphingobium
yanoikuyae) 		PF00067
(p450) 		5 GLY A 250
THR A 254
VAL A 297
ILE A 397
VAL A 398
 HEM  A 501 (-3.8A)
HEM  A 501 (-3.5A)
HEM  A 501 (-4.3A)
None
None
 0.90A 4c9oA-5kyoA:
48.6		 4c9oA-5kyoA:
39.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kyo CYP101J2

(Sphingobium
yanoikuyae) 		PF00067
(p450) 		5 GLY A 251
THR A 254
VAL A 297
ILE A 397
VAL A 398
 HEM  A 501 (-3.3A)
HEM  A 501 (-3.5A)
HEM  A 501 (-4.3A)
None
None
 0.79A 4c9oA-5kyoA:
48.6		 4c9oA-5kyoA:
39.41
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.
5l22 ABC TRANSPORTER
(HLYB SUBFAMILY)

(Aquifex
aeolicus) 		no annotation 5 ILE B 427
LEU B 418
LEU B 469
ILE B 451
VAL B 450
 None
 0.96A 4c9oA-5l22B:
undetectable		 4c9oA-5l22B:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		6 ILE A 413
LEU A 932
GLY A 931
VAL A 449
ASP A 410
VAL A 481
 None
 1.30A 4c9oA-5lq3A:
1.5		 4c9oA-5lq3A:
16.97
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		5 TRP A1453
THR A1454
LEU A1155
LEU A1152
ILE A1457
 None
 1.07A 4c9oA-5n8oA:
undetectable		 4c9oA-5n8oA:
13.72
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.
5nfh METHIONYL-TRNA
SYNTHETASE, PUTATIVE

(Trypanosoma
brucei) 		no annotation 5 THR A 710
LEU A 606
LEU A 610
GLY A 611
VAL A 723
 None
 1.05A 4c9oA-5nfhA:
2.6		 4c9oA-5nfhA:
21.67
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.
5oyn DEHYDRATASE,
ILVD/EDD FAMILY

(Caulobacter
vibrioides) 		no annotation 5 ILE A 447
LEU A 514
LEU A 511
GLY A 510
ILE A 498
 None
 1.06A 4c9oA-5oynA:
undetectable		 4c9oA-5oynA:
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.
5uja BOVINE MULTIDRUG
RESISTANCE PROTEIN 1
(MRP1),MULTIDRUG
RESISTANCE-ASSOCIATE
D PROTEIN 1

(Bos taurus) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 ILE A 726
LEU A 750
LEU A 753
GLY A 756
ILE A 761
 None
 1.04A 4c9oA-5ujaA:
undetectable		 4c9oA-5ujaA:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w5f TAIL TUBE PROTEIN
GP19

(Enterobacteria
phage T4 sensu
lato) 		PF06841
(Phage_T4_gp19) 		5 ILE A 127
LEU A 159
LEU A 132
GLY A 131
ILE A 112
 None
 1.01A 4c9oA-5w5fA:
undetectable		 4c9oA-5w5fA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5woy PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Caldanaerobacter
subterraneus) 		no annotation 5 THR A 181
GLY A 185
THR A 187
VAL A   5
VAL A 203
 None
 1.04A 4c9oA-5woyA:
undetectable		 4c9oA-5woyA:
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.
6f34 AMINO ACID
TRANSPORTER

(Geobacillus
kaustophilus) 		no annotation 5 ILE A 314
THR A  43
LEU A 372
ILE A 165
VAL A 166
 None
ARG  A 501 (-4.6A)
None
None
None
 0.79A 4c9oA-6f34A:
undetectable		 4c9oA-6f34A:
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.
6fm7 BETA-LACTAMASE

(Aeromonas
enteropelogenes) 		no annotation 5 ILE A 222
THR A 185
THR A  70
LEU A 182
LEU A 180
 None
 1.00A 4c9oA-6fm7A:
undetectable		 4c9oA-6fm7A:
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.
6fpe TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN TSAB

(Thermotoga
maritima) 		no annotation 5 ILE A  25
THR A   8
LEU A   4
THR A  76
ILE A  12
 None
 1.03A 4c9oA-6fpeA:
undetectable		 4c9oA-6fpeA:
undetectable