SIMILAR PATTERNS OF AMINO ACIDS FOR 2Q2H_B_ACTB501

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.
1d0n HORSE PLASMA
GELSOLIN

(Equus caballus) 		PF00626
(Gelsolin) 		3 ARG A 120
SER A 336
TYR A  87
 None
 0.67A 2q2hA-1d0nA:
0.0
2q2hB-1d0nA:
0.0		 2q2hA-1d0nA:
9.74
2q2hB-1d0nA:
9.74
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.
1ff3 PEPTIDE METHIONINE
SULFOXIDE REDUCTASE

(Escherichia
coli) 		PF01625
(PMSR) 		3 ARG A  97
SER A  67
TYR A 181
 None
 1.06A 2q2hA-1ff3A:
0.0
2q2hB-1ff3A:
0.0		 2q2hA-1ff3A:
22.27
2q2hB-1ff3A:
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.
1kkr 3-METHYLASPARTATE
AMMONIA-LYASE

(Citrobacter
amalonaticus) 		PF05034
(MAAL_N)
PF07476
(MAAL_C) 		3 ARG A 177
SER A 173
TYR A 214
 None
 1.05A 2q2hA-1kkrA:
0.0
2q2hB-1kkrA:
0.0		 2q2hA-1kkrA:
16.58
2q2hB-1kkrA:
16.58
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		3 ARG A 485
SER A 481
TYR A 619
 None
 1.03A 2q2hA-1l5jA:
0.3
2q2hB-1l5jA:
0.6		 2q2hA-1l5jA:
10.74
2q2hB-1l5jA:
10.74
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.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		3 ARG A 382
SER A 437
TYR A 378
 None
 0.75A 2q2hA-1lnsA:
0.0
2q2hB-1lnsA:
0.0		 2q2hA-1lnsA:
11.16
2q2hB-1lnsA:
11.16
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.
1lxt PHOSPHOGLUCOMUTASE
(DEPHOSPHO FORM)

(Oryctolagus
cuniculus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A 502
SER A 504
TYR A 516
 None
 1.00A 2q2hA-1lxtA:
0.0
2q2hB-1lxtA:
0.0		 2q2hA-1lxtA:
14.34
2q2hB-1lxtA:
14.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m3v FUSION OF THE LIM
INTERACTING DOMAIN
OF LDB1 AND THE
N-TERMINAL LIM
DOMAIN OF LMO4

(Mus musculus) 		PF00412
(LIM) 		3 ARG A  59
SER A  80
TYR A  50
 None
 1.01A 2q2hA-1m3vA:
0.0
2q2hB-1m3vA:
0.0		 2q2hA-1m3vA:
21.09
2q2hB-1m3vA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nvm 4-HYDROXY-2-OXOVALER
ATE ALDOLASE

(Pseudomonas sp.
CF600) 		PF00682
(HMGL-like)
PF07836
(DmpG_comm) 		3 ARG A 222
SER A  46
TYR A 167
 None
 0.81A 2q2hA-1nvmA:
0.0
2q2hB-1nvmA:
0.0		 2q2hA-1nvmA:
18.01
2q2hB-1nvmA:
18.01
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.
1osn THYMIDINE KINASE

(Human
alphaherpesvirus
3) 		PF00693
(Herpes_TK) 		3 ARG A  14
SER A 105
TYR A  16
 None
 0.66A 2q2hA-1osnA:
0.0
2q2hB-1osnA:
0.0		 2q2hA-1osnA:
17.51
2q2hB-1osnA:
17.51
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.
1ouo NUCLEASE

(Vibrio
vulnificus) 		PF04231
(Endonuclease_1) 		3 ARG A 209
SER A 169
TYR A  35
 None
 1.05A 2q2hA-1ouoA:
undetectable
2q2hB-1ouoA:
undetectable		 2q2hA-1ouoA:
20.93
2q2hB-1ouoA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oz9 HYPOTHETICAL PROTEIN
AQ_1354

(Aquifex
aeolicus) 		PF02130
(UPF0054) 		3 ARG A  10
SER A  44
TYR A  81
 None
 1.00A 2q2hA-1oz9A:
undetectable
2q2hB-1oz9A:
undetectable		 2q2hA-1oz9A:
17.95
2q2hB-1oz9A:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1prn PORIN

(Rhodobacter
blasticus) 		PF13609
(Porin_4) 		3 ARG A  30
SER A 119
TYR A   7
 None
 0.94A 2q2hA-1prnA:
undetectable
2q2hB-1prnA:
undetectable		 2q2hA-1prnA:
16.67
2q2hB-1prnA:
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.
1rh9 ENDO-BETA-MANNANASE

(Solanum
lycopersicum) 		PF00150
(Cellulase) 		3 ARG A 333
SER A 381
TYR A 328
 None
 1.05A 2q2hA-1rh9A:
undetectable
2q2hB-1rh9A:
undetectable		 2q2hA-1rh9A:
15.16
2q2hB-1rh9A:
15.16
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.
1tuo PUTATIVE
PHOSPHOMANNOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A 431
SER A 433
TYR A 442
 None
 0.93A 2q2hA-1tuoA:
undetectable
2q2hB-1tuoA:
undetectable		 2q2hA-1tuoA:
15.02
2q2hB-1tuoA:
15.02
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.
1w5f CELL DIVISION
PROTEIN FTSZ

(Thermotoga
maritima) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		3 ARG A 218
SER A 221
TYR A 216
 None
 1.05A 2q2hA-1w5fA:
undetectable
2q2hB-1w5fA:
undetectable		 2q2hA-1w5fA:
18.47
2q2hB-1w5fA:
18.47
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.
1z6o FERRITIN LIGHT CHAIN
FERRITIN HEAVY CHAIN

(Trichoplusia
ni;
Trichoplusia ni) 		PF00210
(Ferritin)
PF00210
(Ferritin) 		3 ARG M  68
SER M  65
TYR A  53
 None
 0.93A 2q2hA-1z6oM:
undetectable
2q2hB-1z6oM:
undetectable		 2q2hA-1z6oM:
22.28
2q2hB-1z6oM:
22.28
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		3 ARG A 204
SER A 322
TYR A 228
 None
 0.97A 2q2hA-1z8lA:
undetectable
2q2hB-1z8lA:
undetectable		 2q2hA-1z8lA:
11.17
2q2hB-1z8lA:
11.17
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.
1zq1 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT D
GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT E

(Pyrococcus
abyssi;
Pyrococcus
abyssi) 		PF00710
(Asparaginase)
PF02637
(GatB_Yqey)
PF02934
(GatB_N)
PF02938
(GAD) 		3 ARG C  48
SER A 212
TYR C  76
 None
 0.93A 2q2hA-1zq1C:
undetectable
2q2hB-1zq1C:
undetectable		 2q2hA-1zq1C:
11.06
2q2hB-1zq1C:
11.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bb3 COBALAMIN
BIOSYNTHESIS
PRECORRIN-6Y
METHYLASE (CBIE)

(Archaeoglobus
fulgidus) 		PF00590
(TP_methylase) 		3 ARG A  33
SER A  31
TYR A 186
 None
 1.04A 2q2hA-2bb3A:
undetectable
2q2hB-2bb3A:
undetectable		 2q2hA-2bb3A:
23.66
2q2hB-2bb3A:
23.66
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.
2d6f GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT D
GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT E

(Methanothermobacter
thermautotrophicus;
Methanothermobacter
thermautotrophicus) 		PF00710
(Asparaginase)
PF02637
(GatB_Yqey)
PF02934
(GatB_N)
PF02938
(GAD) 		3 ARG C  43
SER A 210
TYR C  71
 None
 0.85A 2q2hA-2d6fC:
undetectable
2q2hB-2d6fC:
undetectable		 2q2hA-2d6fC:
12.50
2q2hB-2d6fC:
12.50
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.
2f06 CONSERVED
HYPOTHETICAL PROTEIN

(Bacteroides
thetaiotaomicron) 		no annotation 3 ARG A  46
SER A   7
TYR A 101
 None
 0.98A 2q2hA-2f06A:
undetectable
2q2hB-2f06A:
undetectable		 2q2hA-2f06A:
24.52
2q2hB-2f06A:
24.52
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.
2faq PROBABLE
ATP-DEPENDENT DNA
LIGASE

(Pseudomonas
aeruginosa) 		no annotation 3 ARG A 665
SER A 656
TYR A 822
 None
 1.01A 2q2hA-2faqA:
undetectable
2q2hB-2faqA:
undetectable		 2q2hA-2faqA:
16.72
2q2hB-2faqA:
16.72
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.
2g39 ACETYL-COA HYDROLASE

(Pseudomonas
aeruginosa) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		3 ARG A 118
SER A 152
TYR A 183
 ACY  A 903 (-3.9A)
ACY  A 903 (-2.5A)
ACY  A 903 (-4.4A)
 1.00A 2q2hA-2g39A:
undetectable
2q2hB-2g39A:
undetectable		 2q2hA-2g39A:
15.06
2q2hB-2g39A:
15.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j22 FUCOLECTIN-RELATED
PROTEIN

(Streptococcus
pneumoniae) 		PF00754
(F5_F8_type_C) 		3 ARG A 128
SER A 130
TYR A  95
 None
 0.67A 2q2hA-2j22A:
undetectable
2q2hB-2j22A:
undetectable		 2q2hA-2j22A:
21.51
2q2hB-2j22A:
21.51
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.
2kbx INTEGRIN-LINKED
PROTEIN KINASE
LIM AND SENESCENT
CELL
ANTIGEN-LIKE-CONTAIN
ING DOMAIN PROTEIN 1

(Homo sapiens;
Homo sapiens) 		PF12796
(Ank_2)
PF00412
(LIM) 		3 ARG B  56
SER A  76
TYR B  58
 None
 1.01A 2q2hA-2kbxB:
undetectable
2q2hB-2kbxB:
undetectable		 2q2hA-2kbxB:
18.75
2q2hB-2kbxB:
18.75
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.
2mbr URIDINE
DIPHOSPHO-N-ACETYLEN
OLPYRUVYLGLUCOSAMINE
REDUCTASE

(Escherichia
coli) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		3 ARG A 159
SER A 229
TYR A 158
 FAD  A 401 ( 3.2A)
EPU  A 402 (-3.0A)
EPU  A 402 (-4.2A)
 0.99A 2q2hA-2mbrA:
undetectable
2q2hB-2mbrA:
undetectable		 2q2hA-2mbrA:
17.65
2q2hB-2mbrA:
17.65
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.
2n2e NISIN IMMUNITY
PROTEIN

(Lactococcus
lactis) 		no annotation 3 ARG A 161
SER A 170
TYR A 195
 None
 0.90A 2q2hA-2n2eA:
undetectable
2q2hB-2n2eA:
undetectable		 2q2hA-2n2eA:
25.85
2q2hB-2n2eA:
25.85
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.
2pbi REGULATOR OF
G-PROTEIN SIGNALING
9

(Mus musculus) 		PF00610
(DEP)
PF00615
(RGS)
PF00631
(G-gamma) 		3 ARG A 102
SER A  45
TYR A  84
 None
 0.67A 2q2hA-2pbiA:
undetectable
2q2hB-2pbiA:
undetectable		 2q2hA-2pbiA:
13.44
2q2hB-2pbiA:
13.44
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		3 ARG A 359
SER A 384
TYR A 358
 None
 0.94A 2q2hA-2r4jA:
undetectable
2q2hB-2r4jA:
undetectable		 2q2hA-2r4jA:
13.41
2q2hB-2r4jA:
13.41
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.
2vdf OUTER MEMBRANE
PROTEIN

(Neisseria
meningitidis) 		PF07239
(OpcA) 		3 ARG A 243
SER A 241
TYR A 213
 None
 1.06A 2q2hA-2vdfA:
undetectable
2q2hB-2vdfA:
undetectable		 2q2hA-2vdfA:
20.16
2q2hB-2vdfA:
20.16
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.
2vq0 COAT PROTEIN

(Sesbania mosaic
virus) 		PF00729
(Viral_coat) 		3 ARG A 249
SER A 130
TYR A 251
 None
 1.05A 2q2hA-2vq0A:
undetectable
2q2hB-2vq0A:
undetectable		 2q2hA-2vq0A:
21.40
2q2hB-2vq0A:
21.40
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.
2x4d PHOSPHOLYSINE
PHOSPHOHISTIDINE
INORGANIC
PYROPHOSPHATE
PHOSPHATASE

(Homo sapiens) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		3 ARG A 239
SER A 241
TYR A 158
 GOL  A 503 (-3.9A)
None
None
 1.01A 2q2hA-2x4dA:
undetectable
2q2hB-2x4dA:
undetectable		 2q2hA-2x4dA:
19.34
2q2hB-2x4dA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yn9 POTASSIUM-TRANSPORTI
NG ATPASE ALPHA
CHAIN 1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF09040
(H-K_ATPase_N)
PF13246
(Cation_ATPase) 		3 ARG A 950
SER A 838
TYR A1032
 None
 1.00A 2q2hA-2yn9A:
undetectable
2q2hB-2yn9A:
undetectable		 2q2hA-2yn9A:
8.03
2q2hB-2yn9A:
8.03
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.
2yv1 SUCCINYL-COA LIGASE
[ADP-FORMING]
SUBUNIT ALPHA

(Methanocaldococcus
jannaschii) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		3 ARG A 158
SER A 159
TYR A 193
 None
 0.85A 2q2hA-2yv1A:
undetectable
2q2hB-2yv1A:
undetectable		 2q2hA-2yv1A:
21.85
2q2hB-2yv1A:
21.85
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.
2z23 PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		3 ARG A 413
SER A 368
TYR A 273
 None
 1.01A 2q2hA-2z23A:
undetectable
2q2hB-2z23A:
undetectable		 2q2hA-2z23A:
15.16
2q2hB-2z23A:
15.16
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.
3a8p T-LYMPHOMA INVASION
AND
METASTASIS-INDUCING
PROTEIN 2

(Mus musculus) 		PF00169
(PH) 		3 ARG A 691
SER A 591
TYR A 695
 None
 1.02A 2q2hA-3a8pA:
undetectable
2q2hB-3a8pA:
undetectable		 2q2hA-3a8pA:
17.83
2q2hB-3a8pA:
17.83
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.
3cji POLYPROTEIN

(Senecavirus A) 		PF00073
(Rhv) 		3 ARG B 178
SER B 175
TYR B 111
 None
 1.03A 2q2hA-3cjiB:
undetectable
2q2hB-3cjiB:
undetectable		 2q2hA-3cjiB:
20.92
2q2hB-3cjiB:
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.
3crw XPD/RAD3 RELATED DNA
HELICASE

(Sulfolobus
acidocaldarius) 		PF06733
(DEAD_2)
PF13307
(Helicase_C_2) 		3 ARG 1  55
SER 1 322
TYR 1 156
 None
 0.81A 2q2hA-3crw1:
undetectable
2q2hB-3crw1:
undetectable		 2q2hA-3crw1:
13.13
2q2hB-3crw1:
13.13
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.
3g7g UPF0311 PROTEIN
CA_C3321

(Clostridium
acetobutylicum) 		PF11578
(DUF3237) 		3 ARG A  76
SER A  74
TYR A  88
 None
 0.90A 2q2hA-3g7gA:
undetectable
2q2hB-3g7gA:
undetectable		 2q2hA-3g7gA:
20.99
2q2hB-3g7gA:
20.99
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.
3hdi PROCESSING PROTEASE

(Bacillus
halodurans) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		3 ARG A  35
SER A 151
TYR A 214
 None
 0.96A 2q2hA-3hdiA:
undetectable
2q2hB-3hdiA:
undetectable		 2q2hA-3hdiA:
16.19
2q2hB-3hdiA:
16.19
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.
3kx2 PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE PRP43

(Saccharomyces
cerevisiae) 		no annotation 3 ARG B 620
SER B 621
TYR B 586
 None
 0.89A 2q2hA-3kx2B:
undetectable
2q2hB-3kx2B:
undetectable		 2q2hA-3kx2B:
11.62
2q2hB-3kx2B:
11.62
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.
3na0 CHOLESTEROL
SIDE-CHAIN CLEAVAGE
ENZYME,
MITOCHONDRIAL

(Homo sapiens) 		PF00067
(p450) 		3 ARG A 135
SER A 275
TYR A 129
 None
 0.74A 2q2hA-3na0A:
undetectable
2q2hB-3na0A:
undetectable		 2q2hA-3na0A:
16.06
2q2hB-3na0A:
16.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ojy COMPLEMENT COMPONENT
C8 ALPHA CHAIN

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00090
(TSP_1)
PF01823
(MACPF) 		3 ARG A 261
SER A 196
TYR A 200
 None
 0.93A 2q2hA-3ojyA:
undetectable
2q2hB-3ojyA:
undetectable		 2q2hA-3ojyA:
13.00
2q2hB-3ojyA:
13.00
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.
3pie 5'->3'
EXORIBONUCLEASE
(XRN1)

(Kluyveromyces
lactis) 		PF03159
(XRN_N) 		3 ARG A 566
SER A 568
TYR A 516
 None
 0.94A 2q2hA-3pieA:
undetectable
2q2hB-3pieA:
undetectable		 2q2hA-3pieA:
8.46
2q2hB-3pieA:
8.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tch PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		3 ARG A 439
SER A 394
TYR A 299
 None
 0.92A 2q2hA-3tchA:
undetectable
2q2hB-3tchA:
undetectable		 2q2hA-3tchA:
12.26
2q2hB-3tchA:
12.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u44 ATP-DEPENDENT
HELICASE/NUCLEASE
SUBUNIT A

(Bacillus
subtilis) 		PF00580
(UvrD-helicase)
PF12705
(PDDEXK_1)
PF13361
(UvrD_C) 		3 ARG A 590
SER A 591
TYR A 916
 None
 0.96A 2q2hA-3u44A:
undetectable
2q2hB-3u44A:
undetectable		 2q2hA-3u44A:
7.84
2q2hB-3u44A:
7.84
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.
3va6 TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE

(Bacteroides
thetaiotaomicron) 		PF07494
(Reg_prop)
PF07495
(Y_Y_Y) 		3 ARG A 678
SER A 676
TYR A 114
 None
 1.00A 2q2hA-3va6A:
undetectable
2q2hB-3va6A:
undetectable		 2q2hA-3va6A:
9.87
2q2hB-3va6A:
9.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ze6 PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		3 ARG A 198
SER A 195
TYR A 124
 None
 0.93A 2q2hA-3ze6A:
undetectable
2q2hB-3ze6A:
undetectable		 2q2hA-3ze6A:
20.00
2q2hB-3ze6A:
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.
4a5k PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE-BIN
DING PROTEIN SLM 1

(Saccharomyces
cerevisiae) 		PF00169
(PH) 		3 ARG A 477
SER A 486
TYR A 490
 None
 1.04A 2q2hA-4a5kA:
undetectable
2q2hB-4a5kA:
undetectable		 2q2hA-4a5kA:
21.21
2q2hB-4a5kA:
21.21
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.
4bfc 3-DEOXY-D-MANNO-OCTU
LOSONIC-ACID
TRANSFERASE

(Acinetobacter
baumannii) 		no annotation 3 ARG A 296
SER A 313
TYR A 309
 None
 0.98A 2q2hA-4bfcA:
undetectable
2q2hB-4bfcA:
undetectable		 2q2hA-4bfcA:
21.58
2q2hB-4bfcA:
21.58
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.
4bom ENVELOPE
GLYCOPROTEIN B

(Human
alphaherpesvirus
1) 		PF00606
(Glycoprotein_B)
PF17416
(Glycoprot_B_PH1)
PF17417
(Glycoprot_B_PH2) 		3 ARG A 474
SER A 473
TYR A 442
 None
 1.03A 2q2hA-4bomA:
undetectable
2q2hB-4bomA:
undetectable		 2q2hA-4bomA:
12.62
2q2hB-4bomA:
12.62
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.
4bqi ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC

(Arabidopsis
thaliana) 		PF00343
(Phosphorylase) 		3 ARG A 315
SER A 314
TYR A  74
 None
 0.82A 2q2hA-4bqiA:
undetectable
2q2hB-4bqiA:
undetectable		 2q2hA-4bqiA:
10.68
2q2hB-4bqiA:
10.68
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.
4c1s GLYCOSIDE HYDROLASE
FAMILY 76
MANNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF03663
(Glyco_hydro_76) 		3 ARG A 156
SER A 478
TYR A 514
 None
 1.04A 2q2hA-4c1sA:
undetectable
2q2hB-4c1sA:
undetectable		 2q2hA-4c1sA:
15.00
2q2hB-4c1sA:
15.00
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.
4c3h DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA190

(Saccharomyces
cerevisiae) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 ARG A 123
SER A 186
TYR A 337
 None
 0.94A 2q2hA-4c3hA:
undetectable
2q2hB-4c3hA:
undetectable		 2q2hA-4c3hA:
6.27
2q2hB-4c3hA:
6.27
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.
4cj0 ENDOGLUCANASE D

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		3 ARG A 519
SER A 520
TYR A 202
 None
 0.83A 2q2hA-4cj0A:
undetectable
2q2hB-4cj0A:
undetectable		 2q2hA-4cj0A:
12.56
2q2hB-4cj0A:
12.56
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.
4cvc ALCOHOL
DEHYDROGENASE

(Pseudogluconobacter
saccharoketogenes) 		PF13360
(PQQ_2) 		3 ARG A 536
SER A 548
TYR A 508
 None
ZN  A1613 (-2.2A)
None
 0.86A 2q2hA-4cvcA:
undetectable
2q2hB-4cvcA:
undetectable		 2q2hA-4cvcA:
12.76
2q2hB-4cvcA:
12.76
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.
4epp POLY(ADP-RIBOSE)
GLYCOHYDROLASE

(Tetrahymena
thermophila) 		PF05028
(PARG_cat) 		3 ARG A  58
SER A  60
TYR A  68
 None
 0.79A 2q2hA-4eppA:
undetectable
2q2hB-4eppA:
undetectable		 2q2hA-4eppA:
14.69
2q2hB-4eppA:
14.69
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.
4f52 CULLIN-1

(Homo sapiens) 		PF00888
(Cullin) 		3 ARG A 577
SER A 541
TYR A 570
 None
 1.01A 2q2hA-4f52A:
undetectable
2q2hB-4f52A:
undetectable		 2q2hA-4f52A:
18.09
2q2hB-4f52A:
18.09
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.
4fd7 PUTATIVE
ARYLALKYLAMINE
N-ACETYLTRANSFERASE
7

(Aedes aegypti) 		PF00583
(Acetyltransf_1) 		3 ARG A  92
SER A  95
TYR A 159
 None
 0.97A 2q2hA-4fd7A:
undetectable
2q2hB-4fd7A:
undetectable		 2q2hA-4fd7A:
21.74
2q2hB-4fd7A:
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.
4hkt INOSITOL
2-DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 ARG A 151
SER A 228
TYR A 233
 None
 0.98A 2q2hA-4hktA:
undetectable
2q2hB-4hktA:
undetectable		 2q2hA-4hktA:
17.82
2q2hB-4hktA:
17.82
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.
4hu0 CELLULASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		3 ARG A  89
SER A  91
TYR A 345
 None
None
GOL  A 404 ( 4.8A)
 1.01A 2q2hA-4hu0A:
undetectable
2q2hB-4hu0A:
undetectable		 2q2hA-4hu0A:
16.81
2q2hB-4hu0A:
16.81
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.
4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN

(Rhodopirellula
baltica) 		PF13458
(Peripla_BP_6) 		3 ARG A 231
SER A 200
TYR A 101
 None
None
FMT  A 501 (-4.6A)
 0.84A 2q2hA-4kv7A:
undetectable
2q2hB-4kv7A:
undetectable		 2q2hA-4kv7A:
16.62
2q2hB-4kv7A:
16.62
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.
4kw3 NS1

(Human bocavirus) 		no annotation 3 ARG A 217
SER A 230
TYR A 242
 None
 1.02A 2q2hA-4kw3A:
undetectable
2q2hB-4kw3A:
undetectable		 2q2hA-4kw3A:
18.45
2q2hB-4kw3A:
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.
4l4i RYANODINE RECEPTOR 2

(Mus musculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		3 ARG A 298
SER A  63
TYR A 305
 None
 1.03A 2q2hA-4l4iA:
undetectable
2q2hB-4l4iA:
undetectable		 2q2hA-4l4iA:
12.39
2q2hB-4l4iA:
12.39
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.
4me4 METAL DEPENDENT
PHOSPHOHYDROLASE

(Persephonella
marina) 		PF01590
(GAF)
PF01966
(HD) 		3 ARG A 192
SER A 312
TYR A 196
 None
 0.93A 2q2hA-4me4A:
undetectable
2q2hB-4me4A:
undetectable		 2q2hA-4me4A:
19.68
2q2hB-4me4A:
19.68
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.
4mxe N-ACETYLTRANSFERASE
ESCO1

(Homo sapiens) 		PF13880
(Acetyltransf_13) 		3 ARG A 792
SER A 793
TYR A 822
 None
 1.03A 2q2hA-4mxeA:
undetectable
2q2hB-4mxeA:
undetectable		 2q2hA-4mxeA:
19.42
2q2hB-4mxeA:
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.
4nn1 TRANSCRIPTIONAL
REGULATOR

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		3 ARG A 137
SER A 136
TYR A 197
 None
 0.86A 2q2hA-4nn1A:
undetectable
2q2hB-4nn1A:
undetectable		 2q2hA-4nn1A:
20.52
2q2hB-4nn1A:
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.
4ofd KIN OF IRRE-LIKE
PROTEIN 1

(Mus musculus) 		PF07679
(I-set)
PF08205
(C2-set_2) 		3 ARG A  75
SER A  97
TYR A  76
 None
 1.04A 2q2hA-4ofdA:
undetectable
2q2hB-4ofdA:
undetectable		 2q2hA-4ofdA:
19.70
2q2hB-4ofdA:
19.70
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.
4om9 SERINE PROTEASE PET

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		3 ARG A 495
SER A 592
TYR A 620
 None
 1.03A 2q2hA-4om9A:
undetectable
2q2hB-4om9A:
undetectable		 2q2hA-4om9A:
9.46
2q2hB-4om9A:
9.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pf1 PEPTIDASE
S15/COCE/NOND

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		3 ARG A 436
SER A 448
TYR A 435
 None
 0.98A 2q2hA-4pf1A:
undetectable
2q2hB-4pf1A:
undetectable		 2q2hA-4pf1A:
12.46
2q2hB-4pf1A:
12.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r8z CYCLIC DI-GMP
PHOSPHODIESTERASE

(Pseudomonas
aeruginosa) 		PF13487
(HD_5) 		3 ARG A 183
SER A 317
TYR A 187
 None
 0.87A 2q2hA-4r8zA:
undetectable
2q2hB-4r8zA:
undetectable		 2q2hA-4r8zA:
19.63
2q2hB-4r8zA:
19.63
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.
4ra7 PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Atopobium
parvulum) 		PF00905
(Transpeptidase) 		3 ARG A 672
SER A 648
TYR A 678
 None
 1.00A 2q2hA-4ra7A:
undetectable
2q2hB-4ra7A:
undetectable		 2q2hA-4ra7A:
14.89
2q2hB-4ra7A:
14.89
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.
4raa PUTATIVE EXPORTED
PROTEIN

(Bacteroides
fragilis) 		PF17170
(DUF5128) 		3 ARG A 146
SER A 185
TYR A 144
 PO4  A 400 (-3.7A)
None
None
 0.98A 2q2hA-4raaA:
undetectable
2q2hB-4raaA:
undetectable		 2q2hA-4raaA:
15.57
2q2hB-4raaA:
15.57
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.
4u0z ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE FICD

(Homo sapiens) 		PF02661
(Fic) 		3 ARG A 374
SER A 373
TYR A 399
 APC  A 501 (-3.3A)
None
APC  A 501 (-4.8A)
 0.86A 2q2hA-4u0zA:
undetectable
2q2hB-4u0zA:
undetectable		 2q2hA-4u0zA:
18.21
2q2hB-4u0zA:
18.21
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.
4ux8 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
GDNF FAMILY RECEPTOR
ALPHA-1

(Homo sapiens;
Rattus
norvegicus) 		PF00028
(Cadherin)
PF02351
(GDNF) 		3 ARG A 144
SER C  42
TYR A 146
 None
 0.80A 2q2hA-4ux8A:
undetectable
2q2hB-4ux8A:
undetectable		 2q2hA-4ux8A:
12.27
2q2hB-4ux8A:
12.27
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.
4y2e DUAL SPECIFICITY
PROTEIN PHOSPHATASE
7

(Homo sapiens) 		PF00782
(DSPc) 		3 ARG A 222
SER A 223
TYR A 246
 None
 0.92A 2q2hA-4y2eA:
undetectable
2q2hB-4y2eA:
undetectable		 2q2hA-4y2eA:
22.84
2q2hB-4y2eA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zqb NADP-DEPENDENT
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF02826
(2-Hacid_dh_C) 		3 ARG A 168
SER A 169
TYR A 313
 None
NAP  A 401 (-2.7A)
NAP  A 401 (-3.7A)
 0.76A 2q2hA-4zqbA:
undetectable
2q2hB-4zqbA:
undetectable		 2q2hA-4zqbA:
18.47
2q2hB-4zqbA:
18.47
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.
5aq1 GLUCOSE-6-PHOSPHATE
DEHYDROGENASE

(Trypanosoma
cruzi) 		PF00479
(G6PD_N)
PF02781
(G6PD_C) 		3 ARG A 109
SER A 110
TYR A 151
 NDP  A 551 (-3.3A)
NDP  A 551 (-2.6A)
NDP  A 551 (-4.3A)
 0.98A 2q2hA-5aq1A:
undetectable
2q2hB-5aq1A:
undetectable		 2q2hA-5aq1A:
15.32
2q2hB-5aq1A:
15.32
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.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		3 ARG A 941
SER A 829
TYR A1022
 None
 0.82A 2q2hA-5aw4A:
undetectable
2q2hB-5aw4A:
undetectable		 2q2hA-5aw4A:
8.17
2q2hB-5aw4A:
8.17
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.
5f8z PLASMA KALLIKREIN
LIGHT CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		3 ARG A 208
SER A 125
TYR A 133
 None
 0.97A 2q2hA-5f8zA:
undetectable
2q2hB-5f8zA:
undetectable		 2q2hA-5f8zA:
17.95
2q2hB-5f8zA:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fql IDURONATE-2-SULFATAS
E

(Homo sapiens) 		PF00884
(Sulfatase) 		3 ARG A 110
SER A 152
TYR A 108
 NAG  A1552 ( 4.9A)
None
NAG  A1555 (-4.0A)
 0.79A 2q2hA-5fqlA:
undetectable
2q2hB-5fqlA:
undetectable		 2q2hA-5fqlA:
14.43
2q2hB-5fqlA:
14.43
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.
5hyp C4B-BINDING PROTEIN
ALPHA CHAIN
M28 PROTEIN

(Homo sapiens;
Streptococcus
pyogenes) 		PF00084
(Sushi)
no annotation 		3 ARG A  64
SER A  83
TYR B  62
 None
 1.00A 2q2hA-5hypA:
undetectable
2q2hB-5hypA:
undetectable		 2q2hA-5hypA:
20.81
2q2hB-5hypA:
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 ARG A 632
SER A 661
TYR A 682
 None
 1.06A 2q2hA-5i8iA:
undetectable
2q2hB-5i8iA:
1.2		 2q2hA-5i8iA:
6.23
2q2hB-5i8iA:
6.23
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.
5jsy PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		3 ARG A 198
SER A 195
TYR A 124
 None
 0.90A 2q2hA-5jsyA:
undetectable
2q2hB-5jsyA:
undetectable		 2q2hA-5jsyA:
18.79
2q2hB-5jsyA:
18.79
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.
5ktk POLYKETIDE SYNTHASE
PKSJ

(Bacillus
subtilis) 		PF08659
(KR) 		3 ARG A 194
SER A 180
TYR A 189
 None
 0.56A 2q2hA-5ktkA:
undetectable
2q2hB-5ktkA:
undetectable		 2q2hA-5ktkA:
13.65
2q2hB-5ktkA:
13.65
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.
5kwd ANKYRIN
REPEAT-CONTAINING
PROTEIN

(Metallosphaera
yellowstonensis) 		PF12796
(Ank_2) 		3 ARG A  70
SER A 100
TYR A 108
 None
 1.00A 2q2hA-5kwdA:
undetectable
2q2hB-5kwdA:
undetectable		 2q2hA-5kwdA:
21.52
2q2hB-5kwdA:
21.52
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.
5lp4 PENICILLIN-BINDING
PROTEIN 2 (PBP2)

(Helicobacter
pylori) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		3 ARG A 301
SER A 269
TYR A 307
 None
 1.05A 2q2hA-5lp4A:
undetectable
2q2hB-5lp4A:
undetectable		 2q2hA-5lp4A:
13.10
2q2hB-5lp4A:
13.10
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.
5lrb ALPHA-1,4 GLUCAN
PHOSPHORYLASE

(Hordeum vulgare) 		PF00343
(Phosphorylase) 		3 ARG A 359
SER A 358
TYR A 118
 None
 1.02A 2q2hA-5lrbA:
undetectable
2q2hB-5lrbA:
undetectable		 2q2hA-5lrbA:
9.47
2q2hB-5lrbA:
9.47
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.
5m86 TA1207

(Thermoplasma
acidophilum) 		no annotation 3 ARG A 277
SER A 203
TYR A 274
 CL  A 402 (-4.0A)
None
None
 1.06A 2q2hA-5m86A:
undetectable
2q2hB-5m86A:
undetectable		 2q2hA-5m86A:
17.54
2q2hB-5m86A:
17.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n22 XECO2

(Xenopus laevis) 		PF13880
(Acetyltransf_13) 		3 ARG A 659
SER A 660
TYR A 689
 None
 0.93A 2q2hA-5n22A:
undetectable
2q2hB-5n22A:
undetectable		 2q2hA-5n22A:
22.46
2q2hB-5n22A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o3w PEPTIDE CYCLASE 1

(Gypsophila
vaccaria) 		no annotation 3 ARG A  87
SER A 400
TYR A  92
 None
 0.90A 2q2hA-5o3wA:
undetectable
2q2hB-5o3wA:
undetectable		 2q2hA-5o3wA:
undetectable
2q2hB-5o3wA:
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.
5tvo S-ADENOSYLMETHIONINE
DECARBOXYLASE
PROENZYME

(Trypanosoma
brucei) 		PF01536
(SAM_decarbox) 		3 ARG A 223
SER A 229
TYR A 248
 None
 0.88A 2q2hA-5tvoA:
undetectable
2q2hB-5tvoA:
undetectable		 2q2hA-5tvoA:
19.12
2q2hB-5tvoA:
19.12
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.
5ubw DEUBIQUITINASE SSEL

(Salmonella
enterica) 		no annotation 3 ARG A 158
SER A 161
TYR A 335
 None
 0.86A 2q2hA-5ubwA:
undetectable
2q2hB-5ubwA:
undetectable		 2q2hA-5ubwA:
undetectable
2q2hB-5ubwA:
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.
5wtk CRISPR-ASSOCIATED
ENDORIBONUCLEASE
C2C2

(Leptotrichia
shahii) 		no annotation 3 ARG A1278
SER A1276
TYR A1225
 None
 0.92A 2q2hA-5wtkA:
undetectable
2q2hB-5wtkA:
undetectable		 2q2hA-5wtkA:
6.52
2q2hB-5wtkA:
6.52
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.
5xdh PUTATIVE CYTOCHROME
C

(Candidatus
Jettenia caeni) 		no annotation 3 ARG A  42
SER A  50
TYR A  38
 HEM  A 101 (-3.8A)
HEM  A 101 (-2.7A)
HEM  A 101 (-4.8A)
 0.97A 2q2hA-5xdhA:
undetectable
2q2hB-5xdhA:
undetectable		 2q2hA-5xdhA:
undetectable
2q2hB-5xdhA:
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.
5xtb NADH-UBIQUINONE
OXIDOREDUCTASE 75
KDA SUBUNIT,
MITOCHONDRIAL

(Homo sapiens) 		PF00384
(Molybdopterin)
PF09326
(NADH_dhqG_C)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		3 ARG M 382
SER M 650
TYR M 385
 None
 0.91A 2q2hA-5xtbM:
undetectable
2q2hB-5xtbM:
undetectable		 2q2hA-5xtbM:
11.69
2q2hB-5xtbM:
11.69
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.
6cri


(;
) 		no annotation
no annotation 		3 ARG S  42
SER G 360
TYR S  59
 None
 1.01A 2q2hA-6criS:
undetectable
2q2hB-6criS:
undetectable		 2q2hA-6criS:
undetectable
2q2hB-6criS:
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.
6emk TARGET OF RAPAMYCIN
COMPLEX SUBUNIT LST8

(Saccharomyces
cerevisiae) 		no annotation 3 ARG B  56
SER B  33
TYR B  58
 None
 0.88A 2q2hA-6emkB:
undetectable
2q2hB-6emkB:
undetectable		 2q2hA-6emkB:
undetectable
2q2hB-6emkB:
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.
6ey0 T9SS COMPONENT
CYTOPLASMIC MEMBRANE
PROTEIN PORM
LLAMA NANOBODY NB01

(Porphyromonas
gingivalis;
Lama glama) 		no annotation
no annotation 		3 ARG E 100
SER A  90
TYR E  58
 None
 0.88A 2q2hA-6ey0E:
undetectable
2q2hB-6ey0E:
undetectable		 2q2hA-6ey0E:
undetectable
2q2hB-6ey0E:
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.
6eyy ACRIIA6

(Streptococcus
phage 73) 		no annotation 3 ARG A  17
SER A  16
TYR A 157
 None
 0.90A 2q2hA-6eyyA:
undetectable
2q2hB-6eyyA:
undetectable		 2q2hA-6eyyA:
undetectable
2q2hB-6eyyA:
undetectable