SIMILAR PATTERNS OF AMINO ACIDS FOR 2R2V_D_ACTD37_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.
1d9z EXCINUCLEASE UVRABC
COMPONENT UVRB

([Bacillus]
caldotenax) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB) 		3 LYS A 225
ARG A 162
VAL A 241
 None
 0.90A 2r2vC-1d9zA:
0.0
2r2vD-1d9zA:
0.0		 2r2vC-1d9zA:
4.52
2r2vD-1d9zA:
4.52
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.
1h4o PEROXIREDOXIN 5

(Homo sapiens) 		PF08534
(Redoxin) 		3 LYS A  63
ARG A  95
VAL A  70
 None
 1.10A 2r2vC-1h4oA:
0.0
2r2vD-1h4oA:
undetectable		 2r2vC-1h4oA:
13.82
2r2vD-1h4oA:
13.82
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.
1oe5 SINGLE-STRAND
SELECTIVE
MONOFUNCTIONAL
URACIL DNA
GLYCOSYLASE

(Xenopus laevis) 		no annotation 3 LYS A 219
ARG A 214
VAL A 213
 None
 0.96A 2r2vC-1oe5A:
0.0
2r2vD-1oe5A:
undetectable		 2r2vC-1oe5A:
8.79
2r2vD-1oe5A:
8.79
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.
1r44 D-ALANYL-D-ALANINE
DIPEPTIDASE

(Enterococcus
faecium) 		PF01427
(Peptidase_M15) 		3 LYS A   1
ARG A  39
VAL A  41
 None
 1.04A 2r2vC-1r44A:
0.0
2r2vD-1r44A:
0.0		 2r2vC-1r44A:
11.70
2r2vD-1r44A:
11.70
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.
1s4f RNA-DEPENDENT RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		3 LYS A 172
ARG A 285
VAL A 286
 None
 1.07A 2r2vC-1s4fA:
0.0
2r2vD-1s4fA:
0.0		 2r2vC-1s4fA:
6.64
2r2vD-1s4fA:
6.64
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.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus) 		PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc) 		3 LYS A 127
ARG A 152
VAL A 136
 None
 1.11A 2r2vC-1taqA:
0.5
2r2vD-1taqA:
0.3		 2r2vC-1taqA:
7.16
2r2vD-1taqA:
7.16
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.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus) 		PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc) 		3 LYS A 531
ARG A 476
VAL A 474
 None
 0.88A 2r2vC-1taqA:
0.5
2r2vD-1taqA:
0.3		 2r2vC-1taqA:
7.16
2r2vD-1taqA:
7.16
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.
1tme THEILER'S MURINE
ENCEPHALOMYELITIS
VIRUS (SUBUNIT VP1)

(Cardiovirus B) 		no annotation 3 LYS 1 242
ARG 1  32
VAL 1  33
 None
 0.91A 2r2vC-1tme1:
0.0
2r2vD-1tme1:
0.0		 2r2vC-1tme1:
12.43
2r2vD-1tme1:
12.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vbk HYPOTHETICAL PROTEIN
PH1313

(Pyrococcus
horikoshii) 		PF02568
(ThiI)
PF02926
(THUMP) 		3 LYS A 212
ARG A 246
VAL A 240
 None
 1.03A 2r2vC-1vbkA:
0.0
2r2vD-1vbkA:
0.0		 2r2vC-1vbkA:
7.89
2r2vD-1vbkA:
7.89
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.
1vl1 6-PHOSPHOGLUCONOLACT
ONASE

(Thermotoga
maritima) 		PF01182
(Glucosamine_iso) 		3 LYS A 190
ARG A 186
VAL A 218
 CIT  A 300 (-2.6A)
None
None
 1.09A 2r2vC-1vl1A:
0.0
2r2vD-1vl1A:
undetectable		 2r2vC-1vl1A:
11.31
2r2vD-1vl1A:
11.31
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.
1w9c CRM1 PROTEIN

(Homo sapiens) 		PF08767
(CRM1_C) 		3 LYS A 810
ARG A 765
VAL A 763
 None
 1.06A 2r2vC-1w9cA:
undetectable
2r2vD-1w9cA:
undetectable		 2r2vC-1w9cA:
9.68
2r2vD-1w9cA:
9.68
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.
2d3i OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		3 LYS A 603
ARG A 597
VAL A 596
 None
 1.11A 2r2vC-2d3iA:
undetectable
2r2vD-2d3iA:
undetectable		 2r2vC-2d3iA:
6.76
2r2vD-2d3iA:
6.76
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.
2dnx SYNTAXIN-12

(Homo sapiens) 		PF14523
(Syntaxin_2) 		3 LYS A  34
ARG A 112
VAL A 114
 None
 0.92A 2r2vC-2dnxA:
undetectable
2r2vD-2dnxA:
undetectable		 2r2vC-2dnxA:
17.89
2r2vD-2dnxA:
17.89
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.
2i99 MU-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF02423
(OCD_Mu_crystall) 		3 LYS A 291
ARG A 234
VAL A 261
 None
 1.01A 2r2vC-2i99A:
undetectable
2r2vD-2i99A:
undetectable		 2r2vC-2i99A:
8.56
2r2vD-2i99A:
8.56
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.
2j5u MREC PROTEIN

(Listeria
monocytogenes) 		PF04085
(MreC) 		3 LYS A 160
ARG A 182
VAL A 183
 None
 0.99A 2r2vC-2j5uA:
undetectable
2r2vD-2j5uA:
undetectable		 2r2vC-2j5uA:
11.45
2r2vD-2j5uA:
11.45
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.
2jmc SPECTRIN ALPHA
CHAIN, BRAIN AND P41
PEPTIDE CHIMERA

(Gallus gallus) 		PF00018
(SH3_1) 		3 LYS A  28
ARG A   6
VAL A   8
 None
 0.76A 2r2vC-2jmcA:
undetectable
2r2vD-2jmcA:
undetectable		 2r2vC-2jmcA:
19.12
2r2vD-2jmcA:
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.
2lwe PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX58

(Homo sapiens) 		PF16739
(CARD_2) 		3 LYS A 108
ARG A 161
VAL A 156
 None
 1.00A 2r2vC-2lweA:
undetectable
2r2vD-2lweA:
undetectable		 2r2vC-2lweA:
13.48
2r2vD-2lweA:
13.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n0m LIPID MODIFIED
AZURIN PROTEIN

(Neisseria
gonorrhoeae) 		PF00127
(Copper-bind) 		3 LYS A  76
ARG A  81
VAL A  82
 None
 1.05A 2r2vC-2n0mA:
undetectable
2r2vD-2n0mA:
undetectable		 2r2vC-2n0mA:
17.12
2r2vD-2n0mA:
17.12
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.
2n0s FE-HYDROGENASE

(Chlamydomonas
reinhardtii) 		PF02256
(Fe_hyd_SSU)
PF02906
(Fe_hyd_lg_C) 		3 LYS A 163
ARG A 206
VAL A 199
 None
 0.98A 2r2vC-2n0sA:
undetectable
2r2vD-2n0sA:
undetectable		 2r2vC-2n0sA:
10.11
2r2vD-2n0sA:
10.11
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.
2nd1 BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		PF17035
(BET) 		3 LYS A  24
ARG A  76
VAL A  71
 None
 1.01A 2r2vC-2nd1A:
undetectable
2r2vD-2nd1A:
undetectable		 2r2vC-2nd1A:
20.25
2r2vD-2nd1A:
20.25
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.
2og0 EXCISIONASE

(Escherichia
virus Lambda) 		PF07825
(Exc) 		3 LYS A  36
ARG A  26
VAL A  25
 None
 0.92A 2r2vC-2og0A:
undetectable
2r2vD-2og0A:
undetectable		 2r2vC-2og0A:
26.79
2r2vD-2og0A:
26.79
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.
2p0y HYPOTHETICAL PROTEIN
LP_0780

(Lactobacillus
plantarum) 		PF01933
(UPF0052) 		3 LYS A  10
ARG A 333
VAL A 326
 None
 1.04A 2r2vC-2p0yA:
undetectable
2r2vD-2p0yA:
undetectable		 2r2vC-2p0yA:
9.34
2r2vD-2p0yA:
9.34
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.
2px7 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Thermus
thermophilus) 		PF01128
(IspD) 		3 LYS A  21
ARG A  93
VAL A  91
 None
 1.06A 2r2vC-2px7A:
undetectable
2r2vD-2px7A:
undetectable		 2r2vC-2px7A:
10.34
2r2vD-2px7A:
10.34
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.
2qga ADENYLOSUCCINATE
LYASE

(Plasmodium
vivax) 		PF00206
(Lyase_1)
PF08328
(ASL_C) 		3 LYS B 152
ARG B 457
VAL B 455
 None
 0.92A 2r2vC-2qgaB:
undetectable
2r2vD-2qgaB:
undetectable		 2r2vC-2qgaB:
6.47
2r2vD-2qgaB:
6.47
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.
2vmx SERINE
HYDROXYMETHYLTRANSFE
RASE

(Geobacillus
stearothermophilus) 		PF00464
(SHMT) 		3 LYS A  25
ARG A 397
VAL A 400
 None
 1.07A 2r2vC-2vmxA:
undetectable
2r2vD-2vmxA:
undetectable		 2r2vC-2vmxA:
7.28
2r2vD-2vmxA:
7.28
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.
2ziu CROSSOVER JUNCTION
ENDONUCLEASE EME1

(Homo sapiens) 		PF02732
(ERCC4) 		3 LYS B 541
ARG B 534
VAL B 532
 None
 0.86A 2r2vC-2ziuB:
undetectable
2r2vD-2ziuB:
undetectable		 2r2vC-2ziuB:
7.64
2r2vD-2ziuB:
7.64
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.
2zki 199AA LONG
HYPOTHETICAL TRP
REPRESSOR BINDING
PROTEIN

(Sulfurisphaera
tokodaii) 		PF03358
(FMN_red) 		3 LYS A  22
ARG A  38
VAL A   9
 None
SO4  A 502 (-3.2A)
None
 1.11A 2r2vC-2zkiA:
undetectable
2r2vD-2zkiA:
undetectable		 2r2vC-2zkiA:
10.66
2r2vD-2zkiA:
10.66
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.
3a0u RESPONSE REGULATOR

(Thermotoga
maritima) 		PF00072
(Response_reg) 		3 LYS A  40
ARG A  14
VAL A   7
 None
 0.95A 2r2vC-3a0uA:
undetectable
2r2vD-3a0uA:
undetectable		 2r2vC-3a0uA:
16.38
2r2vD-3a0uA:
16.38
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.
3aw9 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Pyrobaculum
calidifontis) 		PF01370
(Epimerase) 		3 LYS A  58
ARG A 102
VAL A 101
 None
 1.05A 2r2vC-3aw9A:
undetectable
2r2vD-3aw9A:
undetectable		 2r2vC-3aw9A:
9.09
2r2vD-3aw9A:
9.09
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.
3b4y PROBABLE
F420-DEPENDENT
GLUCOSE-6-PHOSPHATE
DEHYDROGENASE FGD1

(Mycobacterium
tuberculosis) 		PF00296
(Bac_luciferase) 		3 LYS A 227
ARG A 212
VAL A 211
 None
 0.83A 2r2vC-3b4yA:
undetectable
2r2vD-3b4yA:
undetectable		 2r2vC-3b4yA:
10.78
2r2vD-3b4yA:
10.78
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.
3c5i CHOLINE KINASE

(Plasmodium
knowlesi) 		PF01633
(Choline_kinase) 		3 LYS A  18
ARG A  37
VAL A  52
 None
 0.99A 2r2vC-3c5iA:
undetectable
2r2vD-3c5iA:
undetectable		 2r2vC-3c5iA:
6.23
2r2vD-3c5iA:
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.
3cyq CHEMOTAXIS PROTEIN
MOTB

(Helicobacter
pylori) 		no annotation 3 LYS B 240
ARG B 154
VAL B 155
 None
 0.92A 2r2vC-3cyqB:
undetectable
2r2vD-3cyqB:
undetectable		 2r2vC-3cyqB:
20.00
2r2vD-3cyqB:
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.
3dgz THIOREDOXIN
REDUCTASE 2

(Mus musculus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 LYS A 307
ARG A 285
VAL A 286
 NA7  A 501 ( 4.8A)
FAD  A 500 ( 3.7A)
None
 1.10A 2r2vC-3dgzA:
undetectable
2r2vD-3dgzA:
undetectable		 2r2vC-3dgzA:
4.80
2r2vD-3dgzA:
4.80
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.
3foa TAIL SHEATH PROTEIN
GP18

(Escherichia
virus T4) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N) 		3 LYS A  90
ARG A  86
VAL A  84
 None
 1.08A 2r2vC-3foaA:
undetectable
2r2vD-3foaA:
undetectable		 2r2vC-3foaA:
6.50
2r2vD-3foaA:
6.50
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.
3gbz KINASE, CMGC CDK

(Giardia
intestinalis) 		PF00069
(Pkinase) 		3 LYS A 152
ARG A 111
VAL A 112
 None
 0.99A 2r2vC-3gbzA:
undetectable
2r2vD-3gbzA:
undetectable		 2r2vC-3gbzA:
12.21
2r2vD-3gbzA:
12.21
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.
3gcd RTX TOXIN RTXA

(Vibrio cholerae) 		PF11713
(Peptidase_C80) 		3 LYS A 131
ARG A 165
VAL A 166
 None
 0.79A 2r2vC-3gcdA:
undetectable
2r2vD-3gcdA:
undetectable		 2r2vC-3gcdA:
11.17
2r2vD-3gcdA:
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.
3gon PHOSPHOMEVALONATE
KINASE

(Streptococcus
pneumoniae) 		PF00288
(GHMP_kinases_N) 		3 LYS A 133
ARG A 185
VAL A 170
 None
 0.89A 2r2vC-3gonA:
undetectable
2r2vD-3gonA:
undetectable		 2r2vC-3gonA:
7.93
2r2vD-3gonA:
7.93
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.
3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB

(Bacteroides
thetaiotaomicron) 		PF00092
(VWA) 		3 LYS A  30
ARG A 188
VAL A 141
 CL  A 216 ( 3.9A)
None
None
 0.95A 2r2vC-3ibsA:
undetectable
2r2vD-3ibsA:
undetectable		 2r2vC-3ibsA:
8.72
2r2vD-3ibsA:
8.72
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.
3ikm DNA POLYMERASE
SUBUNIT GAMMA-1

(Homo sapiens) 		PF00476
(DNA_pol_A) 		3 LYS A1090
ARG A1047
VAL A1044
 None
 0.86A 2r2vC-3ikmA:
undetectable
2r2vD-3ikmA:
undetectable		 2r2vC-3ikmA:
3.00
2r2vD-3ikmA:
3.00
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.
3j2n TAIL SHEATH PROTEIN
GP18

(Escherichia
virus T4) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C) 		3 LYS U  90
ARG U  86
VAL U  84
 None
 1.08A 2r2vC-3j2nU:
undetectable
2r2vD-3j2nU:
undetectable		 2r2vC-3j2nU:
4.63
2r2vD-3j2nU:
4.63
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.
3lq1 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE

(Listeria
monocytogenes) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		3 LYS A 222
ARG A 314
VAL A 290
 None
 0.97A 2r2vC-3lq1A:
undetectable
2r2vD-3lq1A:
undetectable		 2r2vC-3lq1A:
7.31
2r2vD-3lq1A:
7.31
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.
3lre KINESIN-LIKE PROTEIN
KIF18A

(Homo sapiens) 		PF00225
(Kinesin) 		3 LYS A 311
ARG A 168
VAL A 162
 None
 0.99A 2r2vC-3lreA:
undetectable
2r2vD-3lreA:
undetectable		 2r2vC-3lreA:
9.85
2r2vD-3lreA:
9.85
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.
3m6j UNCHARACTERIZED
PROTEIN

(Leptospirillum
rubarum) 		no annotation 3 LYS A 124
ARG A  97
VAL A  96
 None
 0.94A 2r2vC-3m6jA:
undetectable
2r2vD-3m6jA:
undetectable		 2r2vC-3m6jA:
14.07
2r2vD-3m6jA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ntd FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Shewanella
loihica) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 LYS A  68
ARG A  76
VAL A  75
 None
 0.94A 2r2vC-3ntdA:
undetectable
2r2vD-3ntdA:
undetectable		 2r2vC-3ntdA:
5.24
2r2vD-3ntdA:
5.24
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.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		3 LYS A 466
ARG A 420
VAL A 419
 None
PO4  A 767 (-4.4A)
None
 0.67A 2r2vC-3o8lA:
undetectable
2r2vD-3o8lA:
undetectable		 2r2vC-3o8lA:
3.78
2r2vD-3o8lA:
3.78
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.
3pp8 GLYOXYLATE/HYDROXYPY
RUVATE REDUCTASE A

(Salmonella
enterica) 		PF02826
(2-Hacid_dh_C) 		3 LYS A 170
ARG A 167
VAL A 179
 None
 1.10A 2r2vC-3pp8A:
undetectable
2r2vD-3pp8A:
undetectable		 2r2vC-3pp8A:
8.44
2r2vD-3pp8A:
8.44
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.
3psh PROTEIN HI_1472

(Haemophilus
influenzae) 		PF01497
(Peripla_BP_2) 		3 LYS A  75
ARG A  79
VAL A  78
 None
 1.01A 2r2vC-3pshA:
undetectable
2r2vD-3pshA:
undetectable		 2r2vC-3pshA:
11.44
2r2vD-3pshA:
11.44
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.
3qt3 PUTATIVE
UNCHARACTERIZED
PROTEIN CPE0426

(Clostridium
perfringens) 		PF06824
(Glyco_hydro_125) 		3 LYS A 315
ARG A 263
VAL A 237
 None
 0.92A 2r2vC-3qt3A:
undetectable
2r2vD-3qt3A:
undetectable		 2r2vC-3qt3A:
5.93
2r2vD-3qt3A:
5.93
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.
3r13 DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Thermotoga
maritima) 		PF01791
(DeoC) 		3 LYS A 198
ARG A  23
VAL A  22
 None
 1.10A 2r2vC-3r13A:
undetectable
2r2vD-3r13A:
undetectable		 2r2vC-3r13A:
8.95
2r2vD-3r13A:
8.95
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.
3stp GALACTONATE
DEHYDRATASE,
PUTATIVE

(Labrenzia
aggregata) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LYS A  72
ARG A   9
VAL A  10
 None
 1.11A 2r2vC-3stpA:
undetectable
2r2vD-3stpA:
undetectable		 2r2vC-3stpA:
8.61
2r2vD-3stpA:
8.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t8y CHEMOTAXIS RESPONSE
REGULATOR
PROTEIN-GLUTAMATE
METHYLESTERASE

(Thermotoga
maritima) 		PF00072
(Response_reg) 		3 LYS A  46
ARG A  18
VAL A  11
 None
 1.01A 2r2vC-3t8yA:
undetectable
2r2vD-3t8yA:
undetectable		 2r2vC-3t8yA:
12.80
2r2vD-3t8yA:
12.80
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		3 LYS A3964
ARG A3957
VAL A3955
 None
 0.97A 2r2vC-3vkgA:
undetectable
2r2vD-3vkgA:
undetectable		 2r2vC-3vkgA:
1.09
2r2vD-3vkgA:
1.09
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.
3wvo CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY

(Thermobifida
fusca) 		PF09481
(CRISPR_Cse1) 		3 LYS A 310
ARG A 304
VAL A 317
 None
 1.10A 2r2vC-3wvoA:
undetectable
2r2vD-3wvoA:
undetectable		 2r2vC-3wvoA:
6.00
2r2vD-3wvoA:
6.00
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.
3wyf GSP1P

(Saccharomyces
cerevisiae) 		PF00071
(Ras) 		3 LYS A 144
ARG A 108
VAL A 111
 None
 0.99A 2r2vC-3wyfA:
undetectable
2r2vD-3wyfA:
undetectable		 2r2vC-3wyfA:
9.30
2r2vD-3wyfA:
9.30
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.
4auq BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 7

(Homo sapiens) 		PF13920
(zf-C3HC4_3) 		3 LYS B 253
ARG B 250
VAL B 260
 None
 1.01A 2r2vC-4auqB:
undetectable
2r2vD-4auqB:
undetectable		 2r2vC-4auqB:
19.35
2r2vD-4auqB:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bva THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE

(Mus musculus) 		PF02423
(OCD_Mu_crystall) 		3 LYS A 290
ARG A 233
VAL A 260
 None
 1.07A 2r2vC-4bvaA:
undetectable
2r2vD-4bvaA:
undetectable		 2r2vC-4bvaA:
8.45
2r2vD-4bvaA:
8.45
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.
4by9 NOP5/NOP56 RELATED
PROTEIN

(Pyrococcus
furiosus) 		PF01798
(Nop) 		3 LYS C 107
ARG C   7
VAL C   6
 None
 0.90A 2r2vC-4by9C:
undetectable
2r2vD-4by9C:
undetectable		 2r2vC-4by9C:
6.42
2r2vD-4by9C:
6.42
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.
4c6s PROBABLE WRKY
TRANSCRIPTION FACTOR
52

(Arabidopsis
thaliana) 		no annotation 3 LYS A  34
ARG A 140
VAL A 139
 None
 1.02A 2r2vC-4c6sA:
undetectable
2r2vD-4c6sA:
undetectable		 2r2vC-4c6sA:
12.23
2r2vD-4c6sA:
12.23
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.
4e8d GLYCOSYL HYDROLASE,
FAMILY 35

(Streptococcus
pneumoniae) 		PF01301
(Glyco_hydro_35) 		3 LYS A 436
ARG A 442
VAL A 414
 None
 1.04A 2r2vC-4e8dA:
undetectable
2r2vD-4e8dA:
undetectable		 2r2vC-4e8dA:
4.38
2r2vD-4e8dA:
4.38
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.
4h4a MITOCHONDRIAL
CARDIOLIPIN
HYDROLASE

(Drosophila
melanogaster) 		PF13091
(PLDc_2) 		3 LYS A 194
ARG A 185
VAL A 181
 None
 0.97A 2r2vC-4h4aA:
undetectable
2r2vD-4h4aA:
undetectable		 2r2vC-4h4aA:
15.89
2r2vD-4h4aA:
15.89
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.
4hc6 HOLO-[ACYL-CARRIER-P
ROTEIN] SYNTHASE

(Mycobacterium
tuberculosis) 		PF01648
(ACPS) 		3 LYS A  57
ARG A  96
VAL A  95
 BR  A 213 (-3.4A)
None
None
 1.06A 2r2vC-4hc6A:
undetectable
2r2vD-4hc6A:
undetectable		 2r2vC-4hc6A:
12.50
2r2vD-4hc6A:
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.
4hnr CHEMOTAXIS PROTEIN
CHEY

(Vibrio cholerae) 		PF00072
(Response_reg) 		3 LYS A  40
ARG A  14
VAL A   7
 None
 1.04A 2r2vC-4hnrA:
undetectable
2r2vD-4hnrA:
undetectable		 2r2vC-4hnrA:
12.71
2r2vD-4hnrA:
12.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4if4 RESPONSE REGULATOR
PROTEIN VRAR

(Staphylococcus
aureus) 		PF00072
(Response_reg)
PF00196
(GerE) 		3 LYS A  43
ARG A  15
VAL A   8
 None
 0.93A 2r2vC-4if4A:
undetectable
2r2vD-4if4A:
undetectable		 2r2vC-4if4A:
13.33
2r2vD-4if4A:
13.33
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.
4l1y SALIVARY NITROPHORIN

(Cimex
lectularius) 		no annotation 3 LYS A  62
ARG A  20
VAL A  21
 None
None
HEM  A 300 (-4.1A)
 1.07A 2r2vC-4l1yA:
undetectable
2r2vD-4l1yA:
undetectable		 2r2vC-4l1yA:
9.50
2r2vD-4l1yA:
9.50
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.
4lan URACIL-5-CARBOXYLATE
DECARBOXYLASE

(Cordyceps
militaris) 		PF04909
(Amidohydro_2) 		3 LYS A   5
ARG A 369
VAL A 368
 None
 1.03A 2r2vC-4lanA:
undetectable
2r2vD-4lanA:
undetectable		 2r2vC-4lanA:
6.23
2r2vD-4lanA:
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.
4mh0 RAS-RELATED PROTEIN
RAP-1B

(Homo sapiens) 		PF00071
(Ras) 		3 LYS R  50
ARG R 163
VAL R 162
 None
 1.11A 2r2vC-4mh0R:
undetectable
2r2vD-4mh0R:
undetectable		 2r2vC-4mh0R:
13.77
2r2vD-4mh0R:
13.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mn0 BEROVIN

(Beroe
abyssicola) 		PF10591
(SPARC_Ca_bdg) 		3 LYS A  90
ARG A 108
VAL A 109
 None
 1.11A 2r2vC-4mn0A:
undetectable
2r2vD-4mn0A:
undetectable		 2r2vC-4mn0A:
11.60
2r2vD-4mn0A:
11.60
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.
4o7i 3'(2'),5'-BISPHOSPHA
TE NUCLEOTIDASE,
PUTATIVE

(Entamoeba
histolytica) 		PF00459
(Inositol_P) 		3 LYS A 230
ARG A 224
VAL A 223
 PO4  A 402 (-2.8A)
None
None
 0.99A 2r2vC-4o7iA:
undetectable
2r2vD-4o7iA:
undetectable		 2r2vC-4o7iA:
9.77
2r2vD-4o7iA:
9.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ybn FLAVIN-NUCLEOTIDE-BI
NDING PROTEIN

(Mycolicibacterium
smegmatis) 		PF12900
(Pyridox_ox_2) 		3 LYS A  18
ARG A  14
VAL A  12
 None
 1.09A 2r2vC-4ybnA:
undetectable
2r2vD-4ybnA:
undetectable		 2r2vC-4ybnA:
11.61
2r2vD-4ybnA:
11.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zfq L,D-TRANSPEPTIDASE 5

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		3 LYS A 187
ARG A 217
VAL A 218
 None
 1.00A 2r2vC-4zfqA:
undetectable
2r2vD-4zfqA:
undetectable		 2r2vC-4zfqA:
7.29
2r2vD-4zfqA:
7.29
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.
5aey PLASMID SEGREGATION
PROTEIN PARM

(Escherichia
coli) 		PF06406
(StbA) 		3 LYS A 291
ARG A 300
VAL A 276
 None
 1.04A 2r2vC-5aeyA:
undetectable
2r2vD-5aeyA:
undetectable		 2r2vC-5aeyA:
9.33
2r2vD-5aeyA:
9.33
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.
5ce8 BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE

(Thermoproteus
uzoniensis) 		PF01063
(Aminotran_4) 		3 LYS A  87
ARG A  82
VAL A  81
 None
 0.85A 2r2vC-5ce8A:
undetectable
2r2vD-5ce8A:
undetectable		 2r2vC-5ce8A:
10.68
2r2vD-5ce8A:
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.
5cwk DESIGNED HELICAL
REPEAT PROTEIN

(synthetic
construct) 		no annotation 3 LYS A  76
ARG A  33
VAL A  32
 None
 1.01A 2r2vC-5cwkA:
undetectable
2r2vD-5cwkA:
undetectable		 2r2vC-5cwkA:
16.78
2r2vD-5cwkA:
16.78
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.
5djn KINESIN-LIKE PROTEIN

(Mus musculus) 		PF16183
(Kinesin_assoc) 		3 LYS A 363
ARG A 369
VAL A 367
 None
 1.06A 2r2vC-5djnA:
undetectable
2r2vD-5djnA:
undetectable		 2r2vC-5djnA:
24.14
2r2vD-5djnA:
24.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dwa TYPE-2 RESTRICTION
ENZYME AGEI

(Thalassobius
gelatinovorus) 		no annotation 3 LYS A 224
ARG A 174
VAL A 175
 None
 1.10A 2r2vC-5dwaA:
undetectable
2r2vD-5dwaA:
undetectable		 2r2vC-5dwaA:
11.82
2r2vD-5dwaA:
11.82
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.
5g5z ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01547
(SBP_bac_1) 		3 LYS A 526
ARG A 468
VAL A 469
 None
 0.87A 2r2vC-5g5zA:
undetectable
2r2vD-5g5zA:
undetectable		 2r2vC-5g5zA:
4.94
2r2vD-5g5zA:
4.94
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.
5gsm EXO-BETA-D-GLUCOSAMI
NIDASE

(Thermococcus
kodakarensis) 		PF02449
(Glyco_hydro_42) 		3 LYS A 438
ARG A 647
VAL A 646
 None
 0.71A 2r2vC-5gsmA:
undetectable
2r2vD-5gsmA:
undetectable		 2r2vC-5gsmA:
5.72
2r2vD-5gsmA:
5.72
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.
5h9u S-ADENOSYLMETHIONINE
SYNTHASE

(Thermus
thermophilus) 		no annotation 3 LYS C 343
ARG C 324
VAL C 325
 None
 0.96A 2r2vC-5h9uC:
undetectable
2r2vD-5h9uC:
undetectable		 2r2vC-5h9uC:
6.95
2r2vD-5h9uC:
6.95
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.
5lfd ALLANTOIN RACEMASE

(Pseudomonas
fluorescens) 		no annotation 3 LYS A   1
ARG A 214
VAL A 213
 None
 0.93A 2r2vC-5lfdA:
undetectable
2r2vD-5lfdA:
undetectable		 2r2vC-5lfdA:
9.92
2r2vD-5lfdA:
9.92
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.
5ms3 KALLIKREIN-8

(Homo sapiens) 		no annotation 3 LYS A  62
ARG A 109
VAL A  85
 None
 0.85A 2r2vC-5ms3A:
undetectable
2r2vD-5ms3A:
undetectable		 2r2vC-5ms3A:
undetectable
2r2vD-5ms3A:
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.
5ng5 MULTIDRUG EFFLUX
PUMP SUBUNIT ACRA

(Escherichia
coli) 		no annotation 3 LYS E 175
ARG E  69
VAL E  68
 None
 1.11A 2r2vC-5ng5E:
undetectable
2r2vD-5ng5E:
undetectable		 2r2vC-5ng5E:
7.49
2r2vD-5ng5E:
7.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5opt 40S RIBOSOMAL
PROTEIN S12
UBIQUITIN/RIBOSOMAL
PROTEIN S27A,
PUTATIVE

(Trypanosoma
cruzi;
Trypanosoma
cruzi) 		no annotation
no annotation 		3 LYS j 142
ARG i  52
VAL j 129
 U  E1721 ( 3.5A)
C  E1722 ( 2.9A)
U  E1721 ( 3.7A)
 1.08A 2r2vC-5optj:
undetectable
2r2vD-5optj:
undetectable		 2r2vC-5optj:
17.39
2r2vD-5optj:
17.39
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.
5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB

(Escherichia
coli) 		no annotation 3 LYS B 206
ARG B 124
VAL B 122
 None
 1.08A 2r2vC-5sv0B:
undetectable
2r2vD-5sv0B:
undetectable		 2r2vC-5sv0B:
10.81
2r2vD-5sv0B:
10.81
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.
5sv9 BOR1P BORON
TRANSPORTER

(Saccharomyces
mikatae) 		PF00955
(HCO3_cotransp) 		3 LYS A 323
ARG A 369
VAL A 375
 None
 1.11A 2r2vC-5sv9A:
undetectable
2r2vD-5sv9A:
undetectable		 2r2vC-5sv9A:
5.13
2r2vD-5sv9A:
5.13
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.
5t3o RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Thermus
thermophilus) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		3 LYS A  79
ARG A  85
VAL A  54
 None
 1.00A 2r2vC-5t3oA:
undetectable
2r2vD-5t3oA:
undetectable		 2r2vC-5t3oA:
8.64
2r2vD-5t3oA:
8.64
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.
5t5w INTERFERON LAMBDA
RECEPTOR 1

(Homo sapiens) 		PF01108
(Tissue_fac) 		3 LYS B   6
ARG B  81
VAL B  80
 None
 0.90A 2r2vC-5t5wB:
undetectable
2r2vD-5t5wB:
undetectable		 2r2vC-5t5wB:
16.31
2r2vD-5t5wB:
16.31
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.
5tjf ALLOPHYCOCYANIN
ALPHA SUBUNIT
ALLOPHYCOCYANIN BETA
SUBUNIT

(Gracilaria
chilensis;
Gracilaria
chilensis) 		PF00502
(Phycobilisome)
PF00502
(Phycobilisome) 		3 LYS A  27
ARG B  39
VAL B  38
 None
PEG  B 202 (-2.4A)
None
 1.00A 2r2vC-5tjfA:
undetectable
2r2vD-5tjfA:
undetectable		 2r2vC-5tjfA:
13.89
2r2vD-5tjfA:
13.89
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.
5tky PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF00012
(HSP70) 		3 LYS A 604
ARG A 553
VAL A 554
 None
 1.01A 2r2vC-5tkyA:
undetectable
2r2vD-5tkyA:
undetectable		 2r2vC-5tkyA:
4.35
2r2vD-5tkyA:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uve SUBSTRATE-BINDING
REGION OF ABC-TYPE
GLYCINE BETAINE
TRANSPORT SYSTEM

(Brucella
abortus) 		PF04069
(OpuAC) 		3 LYS A 158
ARG A 134
VAL A 137
 None
 1.07A 2r2vC-5uveA:
undetectable
2r2vD-5uveA:
undetectable		 2r2vC-5uveA:
8.27
2r2vD-5uveA:
8.27
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.
5x5t ALPHA-KETOGLUTARIC
SEMIALDEHYDE
DEHYDROGENASE

(Azospirillum
brasilense) 		PF00171
(Aldedh) 		3 LYS A 279
ARG A 292
VAL A 260
 None
 1.05A 2r2vC-5x5tA:
undetectable
2r2vD-5x5tA:
undetectable		 2r2vC-5x5tA:
6.17
2r2vD-5x5tA:
6.17
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.
5xox TRNA(HIS)
GUANYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF04446
(Thg1)
PF14413
(Thg1C) 		3 LYS A   5
ARG A  10
VAL A   9
 None
 1.04A 2r2vC-5xoxA:
undetectable
2r2vD-5xoxA:
undetectable		 2r2vC-5xoxA:
10.14
2r2vD-5xoxA:
10.14
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.
6az1 RIBOSOMAL PROTEIN S3

(Leishmania
donovani) 		no annotation 3 LYS C 142
ARG C 115
VAL C 114
 None
 1.11A 2r2vC-6az1C:
undetectable
2r2vD-6az1C:
undetectable		 2r2vC-6az1C:
15.17
2r2vD-6az1C:
15.17
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.
6b0k IOTA-CARRAGEENAN
SULFATASE

(Pseudoalteromonas) 		no annotation 3 LYS A 270
ARG A 207
VAL A 210
 None
 0.88A 2r2vC-6b0kA:
undetectable
2r2vD-6b0kA:
undetectable		 2r2vC-6b0kA:
undetectable
2r2vD-6b0kA:
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.
6bbj TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL, SUBFAMILY
V, MEMBER 4

(Xenopus
tropicalis) 		no annotation 3 LYS A 193
ARG A 156
VAL A 154
 None
 0.90A 2r2vC-6bbjA:
undetectable
2r2vD-6bbjA:
undetectable		 2r2vC-6bbjA:
undetectable
2r2vD-6bbjA:
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.
6c8g TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL, SUBFAMILY
V, MEMBER 4

(Xenopus
tropicalis) 		no annotation 3 LYS A 193
ARG A 156
VAL A 154
 None
 0.88A 2r2vC-6c8gA:
undetectable
2r2vD-6c8gA:
undetectable		 2r2vC-6c8gA:
undetectable
2r2vD-6c8gA:
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.
6c90 EXOSOME RNA HELICASE
MTR4,EXOSOME RNA
HELICASE MTR4

(Homo sapiens) 		no annotation 3 LYS A 301
ARG A  98
VAL A  99
 None
 1.03A 2r2vC-6c90A:
undetectable
2r2vD-6c90A:
undetectable		 2r2vC-6c90A:
undetectable
2r2vD-6c90A:
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.
6dft


(;
) 		no annotation
no annotation 		3 LYS B 228
ARG A 354
VAL A 349
 None
 1.05A 2r2vC-6dftB:
undetectable
2r2vD-6dftB:
undetectable		 2r2vC-6dftB:
undetectable
2r2vD-6dftB:
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 LYS B   6
ARG B  37
VAL B  35
 None
 1.09A 2r2vC-6emkB:
undetectable
2r2vD-6emkB:
undetectable		 2r2vC-6emkB:
undetectable
2r2vD-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.
6fae IQ MOTIF AND SEC7
DOMAIN-CONTAINING
PROTEIN 2

(Homo sapiens) 		no annotation 3 LYS A 501
ARG A 494
VAL A 495
 None
 1.11A 2r2vC-6faeA:
undetectable
2r2vD-6faeA:
undetectable		 2r2vC-6faeA:
undetectable
2r2vD-6faeA:
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.
6ffl MALTOSE/MALTODEXTRIN
TRANSPORT PERMEASE
HOMOLOGUE

(Bdellovibrio
bacteriovorus) 		no annotation 3 LYS A 279
ARG A   4
VAL A   3
 None
 1.09A 2r2vC-6fflA:
undetectable
2r2vD-6fflA:
undetectable		 2r2vC-6fflA:
undetectable
2r2vD-6fflA:
undetectable