SIMILAR PATTERNS OF AMINO ACIDS FOR 1AV2_A_DVAA6

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.
1bnl COLLAGEN XVIII

(Homo sapiens) 		PF06482
(Endostatin) 		3 ALA A  17
VAL A 171
TRP A 120
 None
 0.97A 1av2A-1bnlA:
undetectable
1av2B-1bnlA:
undetectable		 1av2A-1bnlA:
11.21
1av2B-1bnlA:
11.21
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.
1bqy PLASMINOGEN
ACTIVATOR

(Trimeresurus
stejnegeri) 		PF00089
(Trypsin) 		3 ALA A  55
VAL A  99
TRP A 215
 None
0GJ  A   1 ( 4.2A)
None
 0.83A 1av2A-1bqyA:
undetectable
1av2B-1bqyA:
undetectable		 1av2A-1bqyA:
7.01
1av2B-1bqyA:
7.01
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.
1d6m DNA TOPOISOMERASE
III

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		3 ALA A 238
VAL A 224
TRP A 240
 None
 0.95A 1av2A-1d6mA:
undetectable
1av2B-1d6mA:
undetectable		 1av2A-1d6mA:
3.41
1av2B-1d6mA:
3.41
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.
1ezw COENZYME
F420-DEPENDENT
N5,N10-METHYLENETETR
AHYDROMETHANOPTERIN
REDUCTASE

(Methanopyrus
kandleri) 		PF00296
(Bac_luciferase) 		3 ALA A 130
VAL A 154
TRP A 117
 None
 0.97A 1av2A-1ezwA:
undetectable
1av2B-1ezwA:
undetectable		 1av2A-1ezwA:
4.63
1av2B-1ezwA:
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.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		3 ALA A  48
VAL A  53
TRP A 246
 None
 0.89A 1av2A-1hzvA:
undetectable
1av2B-1hzvA:
undetectable		 1av2A-1hzvA:
4.44
1av2B-1hzvA:
4.44
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.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20) 		PF00704
(Glyco_hydro_18) 		3 ALA A 335
VAL A 338
TRP A 378
 None
 0.82A 1av2A-1kfwA:
undetectable
1av2B-1kfwA:
undetectable		 1av2A-1kfwA:
3.19
1av2B-1kfwA:
3.19
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.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		3 ALA A 321
VAL A 163
TRP A 120
 None
 0.87A 1av2A-1l1lA:
undetectable
1av2B-1l1lA:
undetectable		 1av2A-1l1lA:
2.70
1av2B-1l1lA:
2.70
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.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		3 ALA A 646
VAL A 547
TRP A 642
 None
 0.91A 1av2A-1l1lA:
undetectable
1av2B-1l1lA:
undetectable		 1av2A-1l1lA:
2.70
1av2B-1l1lA:
2.70
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.
1n7u ADSORPTION PROTEIN
P2

(Salmonella
virus PRD1) 		PF09214
(Prd1-P2) 		3 ALA A 499
VAL A   6
TRP A 501
 None
 0.97A 1av2A-1n7uA:
undetectable
1av2B-1n7uA:
undetectable		 1av2A-1n7uA:
2.71
1av2B-1n7uA:
2.71
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.
1npm NEUROPSIN

(Mus musculus) 		PF00089
(Trypsin) 		3 ALA A  32
VAL A  45
TRP A  29
 None
 0.91A 1av2A-1npmA:
undetectable
1av2B-1npmA:
undetectable		 1av2A-1npmA:
5.26
1av2B-1npmA:
5.26
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.
1odo PUTATIVE CYTOCHROME
P450 154A1

(Streptomyces
coelicolor) 		PF00067
(p450) 		3 ALA A 184
VAL A 174
TRP A  81
 None
None
PIM  A1408 (-4.6A)
 0.78A 1av2A-1odoA:
undetectable
1av2B-1odoA:
undetectable		 1av2A-1odoA:
14.86
1av2B-1odoA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ppr PERIDININ-CHLOROPHYL
L PROTEIN

(Amphidinium
carterae) 		PF02429
(PCP) 		3 ALA M 238
VAL M 241
TRP M 186
 None
PID  M 624 (-4.2A)
PID  M 624 ( 3.6A)
 0.93A 1av2A-1pprM:
undetectable
1av2B-1pprM:
undetectable		 1av2A-1pprM:
7.10
1av2B-1pprM:
7.10
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.
1qfc PROTEIN (PURPLE ACID
PHOSPHATASE)

(Rattus
norvegicus) 		PF00149
(Metallophos) 		3 ALA A 241
VAL A  12
TRP A  15
 None
 0.86A 1av2A-1qfcA:
undetectable
1av2B-1qfcA:
undetectable		 1av2A-1qfcA:
5.00
1av2B-1qfcA:
5.00
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.
1qhq PROTEIN (AURACYANIN)

(Chloroflexus
aurantiacus) 		PF00127
(Copper-bind) 		3 ALA A  23
VAL A  21
TRP A  59
 None
 0.87A 1av2A-1qhqA:
undetectable
1av2B-1qhqA:
undetectable		 1av2A-1qhqA:
6.43
1av2B-1qhqA:
6.43
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.
1rbl RIBULOSE 1,5
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E (LARGE CHAIN)

(Synechococcus
elongatus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  69
TRP A  70
 None
 0.78A 1av2A-1rblA:
undetectable
1av2B-1rblA:
undetectable		 1av2A-1rblA:
4.08
1av2B-1rblA:
4.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1to3 PUTATIVE ALDOLASE
YIHT

(Salmonella
enterica) 		PF01791
(DeoC) 		3 ALA A 274
VAL A 255
TRP A 256
 None
 0.90A 1av2A-1to3A:
undetectable
1av2B-1to3A:
undetectable		 1av2A-1to3A:
6.40
1av2B-1to3A:
6.40
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.
1tue REGULATORY PROTEIN
E2

(Alphapapillomavirus
7) 		PF00508
(PPV_E2_N) 		3 ALA B 154
VAL B 141
TRP B 138
 None
 0.95A 1av2A-1tueB:
undetectable
1av2B-1tueB:
undetectable		 1av2A-1tueB:
5.70
1av2B-1tueB:
5.70
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.
1u5w HYPOTHETICAL UPF0244
PROTEIN YJJX

(Escherichia
coli) 		PF01931
(NTPase_I-T) 		3 ALA A  77
VAL A   8
TRP A  75
 None
 0.91A 1av2A-1u5wA:
undetectable
1av2B-1u5wA:
undetectable		 1av2A-1u5wA:
6.18
1av2B-1u5wA:
6.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		3 ALA A 174
VAL A 369
TRP A 365
 None
 0.78A 1av2A-1u7gA:
undetectable
1av2B-1u7gA:
undetectable		 1av2A-1u7gA:
5.19
1av2B-1u7gA:
5.19
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.
1up2 CELA1 PROTEIN

(Mycobacterium
tuberculosis) 		PF01341
(Glyco_hydro_6) 		3 ALA A 137
VAL A 139
TRP A 186
 None
 0.93A 1av2A-1up2A:
undetectable
1av2B-1up2A:
undetectable		 1av2A-1up2A:
6.25
1av2B-1up2A:
6.25
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.
1y43 ASPERGILLOPEPSIN II
HEAVY CHAIN

(Aspergillus
niger) 		PF01828
(Peptidase_A4) 		3 ALA B   9
VAL B  11
TRP B 107
 None
 0.48A 1av2A-1y43B:
undetectable
1av2B-1y43B:
undetectable		 1av2A-1y43B:
6.13
1av2B-1y43B:
6.13
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.
2a7w PHOSPHORIBOSYL-ATP
PYROPHOSPHATASE

(Chromobacterium
violaceum) 		PF01503
(PRA-PH) 		3 ALA A  45
VAL A  64
TRP A  68
 None
 0.81A 1av2A-2a7wA:
undetectable
1av2B-2a7wA:
undetectable		 1av2A-2a7wA:
8.04
1av2B-2a7wA:
8.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2btd PTS-DEPENDENT
DIHYDROXYACETONE
KINASE

(Escherichia
coli) 		PF02734
(Dak2) 		3 ALA A 123
VAL A 117
TRP A 134
 ADP  A1211 ( 4.4A)
None
None
 0.93A 1av2A-2btdA:
undetectable
1av2B-2btdA:
undetectable		 1av2A-2btdA:
7.52
1av2B-2btdA:
7.52
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.
2co6 PUTATIVE FIMBRIAE
ASSEMBLY CHAPERONE

(Salmonella
enterica) 		PF00345
(PapD_N)
PF02753
(PapD_C) 		3 ALA B 168
VAL B 170
TRP B 203
 None
 0.83A 1av2A-2co6B:
undetectable
1av2B-2co6B:
undetectable		 1av2A-2co6B:
8.05
1av2B-2co6B:
8.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cwf DELTA1-PIPERIDEINE-2
-CARBOXYLATE
REDUCTASE

(Pseudomonas
syringae group
genomosp. 3) 		PF02615
(Ldh_2) 		3 ALA A  67
VAL A  71
TRP A  70
 None
 0.91A 1av2A-2cwfA:
undetectable
1av2B-2cwfA:
undetectable		 1av2A-2cwfA:
6.22
1av2B-2cwfA:
6.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3y URACIL-DNA
GLYCOSYLASE

(Thermus
thermophilus) 		PF03167
(UDG) 		3 ALA A 116
VAL A  43
TRP A  39
 None
 0.85A 1av2A-2d3yA:
undetectable
1av2B-2d3yA:
undetectable		 1av2A-2d3yA:
8.73
1av2B-2d3yA:
8.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ALA A  85
VAL A 101
TRP A 102
 None
None
MPD  A   1 ( 3.9A)
 0.89A 1av2A-2d4wA:
undetectable
1av2B-2d4wA:
undetectable		 1av2A-2d4wA:
4.98
1av2B-2d4wA:
4.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ffi 2-PYRONE-4,6-DICARBO
XYLIC ACID
HYDROLASE, PUTATIVE

(Pseudomonas
putida) 		PF04909
(Amidohydro_2) 		3 ALA A 215
VAL A 198
TRP A 233
 None
 0.89A 1av2A-2ffiA:
undetectable
1av2B-2ffiA:
undetectable		 1av2A-2ffiA:
5.68
1av2B-2ffiA:
5.68
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.
2hqm GLUTATHIONE
REDUCTASE

(Saccharomyces
cerevisiae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 ALA A 213
VAL A 215
TRP A  73
 None
 0.97A 1av2A-2hqmA:
undetectable
1av2B-2hqmA:
undetectable		 1av2A-2hqmA:
3.19
1av2B-2hqmA:
3.19
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.
2lpu KMATG10

(Kluyveromyces
marxianus) 		PF03987
(Autophagy_act_C) 		3 ALA A 120
VAL A 122
TRP A 133
 None
 0.91A 1av2A-2lpuA:
undetectable
1av2B-2lpuA:
undetectable		 1av2A-2lpuA:
8.26
1av2B-2lpuA:
8.26
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.
2nvn HYPOTHETICAL PROTEIN

(Synechococcus
elongatus) 		PF08848
(DUF1818) 		3 ALA A 106
VAL A 108
TRP A 103
 None
 0.95A 1av2A-2nvnA:
undetectable
1av2B-2nvnA:
undetectable		 1av2A-2nvnA:
10.48
1av2B-2nvnA:
10.48
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.
2pnc COPPER AMINE
OXIDASE, LIVER
ISOZYME

(Bos taurus) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		3 ALA A 427
VAL A 464
TRP A 474
 None
 0.95A 1av2A-2pncA:
undetectable
1av2B-2pncA:
undetectable		 1av2A-2pncA:
3.08
1av2B-2pncA:
3.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vob TRYPANOTHIONE
SYNTHETASE

(Leishmania
major) 		PF03738
(GSP_synth)
PF05257
(CHAP) 		3 ALA A  32
VAL A  30
TRP A  66
 None
 0.97A 1av2A-2vobA:
undetectable
1av2B-2vobA:
undetectable		 1av2A-2vobA:
3.50
1av2B-2vobA:
3.50
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.
2vtc CEL61B

(Trichoderma
reesei) 		PF03443
(Glyco_hydro_61) 		3 ALA A 226
VAL A 116
TRP A 228
 None
 0.92A 1av2A-2vtcA:
undetectable
1av2B-2vtcA:
undetectable		 1av2A-2vtcA:
4.84
1av2B-2vtcA:
4.84
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.
3axx 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		3 ALA A 271
VAL A 298
TRP A 323
 None
 0.77A 1av2A-3axxA:
undetectable
1av2B-3axxA:
undetectable		 1av2A-3axxA:
3.23
1av2B-3axxA:
3.23
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.
3e2s PROLINE
DEHYDROGENASE

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 ALA A 405
VAL A 455
TRP A 438
 None
None
FAD  A2001 (-3.6A)
 0.81A 1av2A-3e2sA:
undetectable
1av2B-3e2sA:
undetectable		 1av2A-3e2sA:
1.86
1av2B-3e2sA:
1.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fsc QDTC

(Thermoanaerobacterium
thermosaccharolyticum) 		PF00132
(Hexapep) 		3 ALA A 195
VAL A 178
TRP A 239
 None
 0.96A 1av2A-3fscA:
undetectable
1av2B-3fscA:
undetectable		 1av2A-3fscA:
13.89
1av2B-3fscA:
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.
3i2t EPIDERMAL GROWTH
FACTOR RECEPTOR,
ISOFORM A

(Drosophila
melanogaster) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		3 ALA A 405
VAL A 430
TRP A 457
 None
 0.88A 1av2A-3i2tA:
undetectable
1av2B-3i2tA:
undetectable		 1av2A-3i2tA:
3.28
1av2B-3i2tA:
3.28
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.
3ian CHITINASE

(Lactococcus
lactis) 		PF00704
(Glyco_hydro_18) 		3 ALA A 327
VAL A 323
TRP A  49
 EDO  A 364 ( 4.2A)
None
None
 0.95A 1av2A-3ianA:
undetectable
1av2B-3ianA:
undetectable		 1av2A-3ianA:
3.25
1av2B-3ianA:
3.25
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.
3jcx FAB E HEAVY CHAIN

(Rattus
norvegicus) 		PF07686
(V-set) 		3 ALA H 192
VAL H 135
TRP H 213
 None
 0.97A 1av2A-3jcxH:
undetectable
1av2B-3jcxH:
undetectable		 1av2A-3jcxH:
9.35
1av2B-3jcxH:
9.35
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.
3l8h PUTATIVE HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bordetella
bronchiseptica) 		PF13242
(Hydrolase_like) 		3 ALA A 134
VAL A 124
TRP A 142
 None
 0.94A 1av2A-3l8hA:
undetectable
1av2B-3l8hA:
undetectable		 1av2A-3l8hA:
9.68
1av2B-3l8hA:
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.
3njb ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		3 ALA A 281
VAL A 283
TRP A 177
 None
 0.88A 1av2A-3njbA:
undetectable
1av2B-3njbA:
undetectable		 1av2A-3njbA:
6.80
1av2B-3njbA:
6.80
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.
3oft CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		3 ALA A 342
VAL A 340
TRP A  61
 None
None
HEM  A 417 (-4.1A)
 0.59A 1av2A-3oftA:
undetectable
1av2B-3oftA:
undetectable		 1av2A-3oftA:
19.64
1av2B-3oftA:
19.64
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.
3pty ARABINOSYLTRANSFERAS
E C

(Mycobacterium
tuberculosis) 		PF14896
(Arabino_trans_C) 		3 ALA A 771
VAL A 769
TRP A 868
 None
 0.87A 1av2A-3ptyA:
undetectable
1av2B-3ptyA:
undetectable		 1av2A-3ptyA:
3.98
1av2B-3ptyA:
3.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA) 		PF09251
(PhageP22-tail) 		3 ALA A 414
VAL A 412
TRP A 457
 None
 0.88A 1av2A-3riqA:
undetectable
1av2B-3riqA:
undetectable		 1av2A-3riqA:
2.24
1av2B-3riqA:
2.24
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.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 3 ALA A 186
VAL A  98
TRP A 146
 None
 0.90A 1av2A-3w36A:
undetectable
1av2B-3w36A:
undetectable		 1av2A-3w36A:
4.62
1av2B-3w36A:
4.62
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.
3w6m 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		3 ALA A 271
VAL A 298
TRP A 323
 None
 0.74A 1av2A-3w6mA:
undetectable
1av2B-3w6mA:
undetectable		 1av2A-3w6mA:
3.53
1av2B-3w6mA:
3.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwe OXIDIZED POLYVINYL
ALCOHOL HYDROLASE

(Pseudomonas sp.
VM15C) 		no annotation 3 ALA A  50
VAL A  92
TRP A  60
 None
 0.97A 1av2A-3wweA:
undetectable
1av2B-3wweA:
undetectable		 1av2A-3wweA:
4.60
1av2B-3wweA:
4.60
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.
4akk NITRATE REGULATORY
PROTEIN

(Klebsiella
oxytoca) 		PF03861
(ANTAR)
PF08376
(NIT) 		3 ALA A 124
VAL A 118
TRP A  56
 None
 0.93A 1av2A-4akkA:
undetectable
1av2B-4akkA:
undetectable		 1av2A-4akkA:
3.24
1av2B-4akkA:
3.24
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.
4akk NITRATE REGULATORY
PROTEIN

(Klebsiella
oxytoca) 		PF03861
(ANTAR)
PF08376
(NIT) 		3 ALA A 125
VAL A 118
TRP A  56
 None
 0.86A 1av2A-4akkA:
undetectable
1av2B-4akkA:
undetectable		 1av2A-4akkA:
3.24
1av2B-4akkA:
3.24
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.
4di1 ENOYL-COA HYDRATASE
ECHA17

(Mycobacterium
marinum) 		PF00378
(ECH_1) 		3 ALA A  49
VAL A  98
TRP A 192
 None
 0.87A 1av2A-4di1A:
undetectable
1av2B-4di1A:
undetectable		 1av2A-4di1A:
17.39
1av2B-4di1A:
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.
4epa PESTICIN RECEPTOR

(Yersinia pestis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ALA A 468
VAL A 470
TRP A 513
 None
 0.76A 1av2A-4epaA:
undetectable
1av2B-4epaA:
undetectable		 1av2A-4epaA:
2.15
1av2B-4epaA:
2.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3

(Homo sapiens) 		PF07686
(V-set)
PF08205
(C2-set_2) 		3 ALA A  68
VAL A 168
TRP A  70
 None
NAG  A 415 ( 4.6A)
NAG  A 415 ( 4.1A)
 0.96A 1av2A-4fomA:
undetectable
1av2B-4fomA:
undetectable		 1av2A-4fomA:
4.86
1av2B-4fomA:
4.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ftd UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		PF15416
(DUF4623) 		3 ALA A 362
VAL A 323
TRP A 334
 None
 0.81A 1av2A-4ftdA:
undetectable
1av2B-4ftdA:
undetectable		 1av2A-4ftdA:
2.43
1av2B-4ftdA:
2.43
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.
4hi4 AEROTAXIS TRANSDUCER
AER2

(Pseudomonas
aeruginosa) 		PF13188
(PAS_8) 		3 ALA A 184
VAL A 202
TRP A 283
 None
 0.51A 1av2A-4hi4A:
undetectable
1av2B-4hi4A:
undetectable		 1av2A-4hi4A:
8.74
1av2B-4hi4A:
8.74
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.
4i6k AMIDOHYDROLASE
FAMILY PROTEIN

(Acinetobacter
baumannii) 		PF04909
(Amidohydro_2) 		3 ALA A 205
VAL A 189
TRP A 223
 None
 0.92A 1av2A-4i6kA:
undetectable
1av2B-4i6kA:
undetectable		 1av2A-4i6kA:
6.03
1av2B-4i6kA:
6.03
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.
4i9r CELLULAR RETINOIC
ACID-BINDING PROTEIN
2

(Homo sapiens) 		PF00061
(Lipocalin) 		3 ALA A  35
VAL A  33
TRP A  32
 None
None
RET  A 201 (-4.5A)
 0.85A 1av2A-4i9rA:
undetectable
1av2B-4i9rA:
undetectable		 1av2A-4i9rA:
10.48
1av2B-4i9rA:
10.48
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.
4j4j DNA DC->DU-EDITING
ENZYME APOBEC-3F

(Homo sapiens) 		PF08210
(APOBEC_N) 		3 ALA A 250
VAL A 242
TRP A 277
 None
 0.78A 1av2A-4j4jA:
undetectable
1av2B-4j4jA:
undetectable		 1av2A-4j4jA:
5.67
1av2B-4j4jA:
5.67
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.
4jpq UNCHARACTERIZED
PROTEIN

(Bacteroides
uniformis) 		PF16011
(CBM9_2) 		3 ALA A 101
VAL A 103
TRP A 185
 None
 0.96A 1av2A-4jpqA:
undetectable
1av2B-4jpqA:
undetectable		 1av2A-4jpqA:
8.11
1av2B-4jpqA:
8.11
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.
4kna N-SUCCINYLGLUTAMATE
5-SEMIALDEHYDE
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00171
(Aldedh) 		3 ALA A 180
VAL A 182
TRP A 185
 None
 0.91A 1av2A-4knaA:
undetectable
1av2B-4knaA:
undetectable		 1av2A-4knaA:
2.72
1av2B-4knaA:
2.72
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.
4m2j AMINOTRANSFERASE

(Streptomyces
lavendulae) 		PF00155
(Aminotran_1_2) 		3 ALA A 239
VAL A  85
TRP A 236
 None
 0.85A 1av2A-4m2jA:
undetectable
1av2B-4m2jA:
undetectable		 1av2A-4m2jA:
3.69
1av2B-4m2jA:
3.69
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.
4m7r ANAMORSIN

(Homo sapiens) 		PF08241
(Methyltransf_11) 		3 ALA A  37
VAL A  68
TRP A  40
 None
 0.91A 1av2A-4m7rA:
undetectable
1av2B-4m7rA:
undetectable		 1av2A-4m7rA:
9.91
1av2B-4m7rA:
9.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  69
TRP A  70
 None
 0.73A 1av2A-4mkvA:
undetectable
1av2B-4mkvA:
undetectable		 1av2A-4mkvA:
3.79
1av2B-4mkvA:
3.79
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.
4mpt PUTATIVE
LEU/ILE/VAL-BINDING
PROTEIN

(Bordetella
pertussis) 		PF13458
(Peripla_BP_6) 		3 ALA A 298
VAL A 301
TRP A 285
 None
 0.93A 1av2A-4mptA:
undetectable
1av2B-4mptA:
undetectable		 1av2A-4mptA:
5.63
1av2B-4mptA:
5.63
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.
4nme PROLINE
DEHYDROGENASE AND
DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE

(Geobacter
sulfurreducens) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		3 ALA A 277
VAL A 326
TRP A 310
 None
None
P5F  A1101 (-3.6A)
 0.82A 1av2A-4nmeA:
undetectable
1av2B-4nmeA:
undetectable		 1av2A-4nmeA:
2.23
1av2B-4nmeA:
2.23
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.
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 ALA A 405
VAL A 455
TRP A 438
 None
None
FAD  A2001 (-3.5A)
 0.81A 1av2A-4o8aA:
undetectable
1av2B-4o8aA:
undetectable		 1av2A-4o8aA:
3.02
1av2B-4o8aA:
3.02
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.
4og1 ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		3 ALA A 154
VAL A 125
TRP A 103
 None
 0.87A 1av2A-4og1A:
undetectable
1av2B-4og1A:
undetectable		 1av2A-4og1A:
7.56
1av2B-4og1A:
7.56
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.
4oqr CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 ALA A 290
VAL A 308
TRP A  48
 None
 0.92A 1av2A-4oqrA:
undetectable
1av2B-4oqrA:
undetectable		 1av2A-4oqrA:
3.20
1av2B-4oqrA:
3.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oqs CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 ALA A 290
VAL A 308
TRP A  48
 None
 0.91A 1av2A-4oqsA:
undetectable
1av2B-4oqsA:
undetectable		 1av2A-4oqsA:
3.20
1av2B-4oqsA:
3.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pvi GH62 HYDROLASE

(Mycothermus
thermophilus) 		PF03664
(Glyco_hydro_62) 		3 ALA A 288
VAL A 290
TRP A  34
 None
 0.70A 1av2A-4pviA:
undetectable
1av2B-4pviA:
undetectable		 1av2A-4pviA:
3.27
1av2B-4pviA:
3.27
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 ALA A 313
VAL A 363
TRP A 346
 None
None
FAD  A2001 (-3.6A)
 0.82A 1av2A-4q73A:
undetectable
1av2B-4q73A:
undetectable		 1av2A-4q73A:
2.58
1av2B-4q73A:
2.58
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.
4ruw ENDONUCLEASE/EXONUCL
EASE/PHOSPHATASE

(Beutenbergia
cavernae) 		PF03372
(Exo_endo_phos) 		3 ALA A 195
VAL A 181
TRP A 124
 None
 0.93A 1av2A-4ruwA:
undetectable
1av2B-4ruwA:
undetectable		 1av2A-4ruwA:
3.08
1av2B-4ruwA:
3.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a7m BETA-XYLOSIDASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 ALA A 578
VAL A 529
TRP A 501
 None
 0.75A 1av2A-5a7mA:
undetectable
1av2B-5a7mA:
undetectable		 1av2A-5a7mA:
1.95
1av2B-5a7mA:
1.95
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		3 ALA A 166
VAL A 213
TRP A 229
 None
 0.83A 1av2A-5a8rA:
undetectable
1av2B-5a8rA:
undetectable		 1av2A-5a8rA:
4.08
1av2B-5a8rA:
4.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aca VP1

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 ALA 1  50
VAL 1 173
TRP 1  89
 None
 0.89A 1av2A-5aca1:
undetectable
1av2B-5aca1:
undetectable		 1av2A-5aca1:
10.61
1av2B-5aca1:
10.61
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		3 ALA A 355
VAL A 391
TRP A 368
 None
 0.91A 1av2A-5cjuA:
undetectable
1av2B-5cjuA:
undetectable		 1av2A-5cjuA:
2.13
1av2B-5cjuA:
2.13
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.
5e7l CONTACTIN-2

(Mus musculus) 		PF00041
(fn3) 		3 ALA A 819
VAL A 821
TRP A 835
 None
 0.96A 1av2A-5e7lA:
undetectable
1av2B-5e7lA:
undetectable		 1av2A-5e7lA:
10.67
1av2B-5e7lA:
10.67
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.
5ebb ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A

(Homo sapiens) 		PF00149
(Metallophos) 		3 ALA A 318
VAL A  43
TRP A 107
 None
 0.90A 1av2A-5ebbA:
undetectable
1av2B-5ebbA:
undetectable		 1av2A-5ebbA:
3.98
1av2B-5ebbA:
3.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ewn STRUCTURAL PROTEIN

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 ALA A 376
VAL A 353
TRP A 351
 None
 0.97A 1av2A-5ewnA:
undetectable
1av2B-5ewnA:
undetectable		 1av2A-5ewnA:
6.37
1av2B-5ewnA:
6.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ewn STRUCTURAL PROTEIN

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 ALA A 376
VAL A 369
TRP A 351
 None
 0.87A 1av2A-5ewnA:
undetectable
1av2B-5ewnA:
undetectable		 1av2A-5ewnA:
6.37
1av2B-5ewnA:
6.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fca ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A

(Mus musculus) 		PF00149
(Metallophos) 		3 ALA A 315
VAL A  40
TRP A 104
 None
 0.93A 1av2A-5fcaA:
undetectable
1av2B-5fcaA:
undetectable		 1av2A-5fcaA:
5.50
1av2B-5fcaA:
5.50
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP4

(Saccharomyces
cerevisiae) 		PF14382
(ECR1_N)
PF15985
(KH_6) 		3 ALA H 117
VAL H 119
TRP H 124
 None
 0.75A 1av2A-5g06H:
undetectable
1av2B-5g06H:
undetectable		 1av2A-5g06H:
4.71
1av2B-5g06H:
4.71
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.
5ibv CAPSID POLYPROTEIN
VP90

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 ALA A 376
VAL A 369
TRP A 351
 None
 0.96A 1av2A-5ibvA:
undetectable
1av2B-5ibvA:
undetectable		 1av2A-5ibvA:
6.86
1av2B-5ibvA:
6.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 ALA A 341
VAL A 391
TRP A 374
 None
None
FAD  A2001 (-3.6A)
 0.81A 1av2A-5kf7A:
undetectable
1av2B-5kf7A:
undetectable		 1av2A-5kf7A:
1.64
1av2B-5kf7A:
1.64
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.
5koh NITROGENASE FEMO
BETA SUBUNIT PROTEIN
NIFK

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		3 ALA B 478
VAL B 472
TRP B 473
 None
 0.56A 1av2A-5kohB:
undetectable
1av2B-5kohB:
undetectable		 1av2A-5kohB:
3.10
1av2B-5kohB:
3.10
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.
5lb8 ATP-DEPENDENT DNA
HELICASE Q5

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind) 		3 ALA A 286
VAL A 310
TRP A 305
 None
 0.97A 1av2A-5lb8A:
undetectable
1av2B-5lb8A:
undetectable		 1av2A-5lb8A:
4.12
1av2B-5lb8A:
4.12
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.
5lpe KALLIKREIN-10

(Homo sapiens) 		PF00089
(Trypsin) 		3 ALA A  43
VAL A  45
TRP A  29
 None
 0.76A 1av2A-5lpeA:
undetectable
1av2B-5lpeA:
undetectable		 1av2A-5lpeA:
11.25
1av2B-5lpeA:
11.25
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.
5ms3 KALLIKREIN-8

(Homo sapiens) 		no annotation 3 ALA A  32
VAL A  45
TRP A  29
 None
 0.93A 1av2A-5ms3A:
undetectable
1av2B-5ms3A:
undetectable		 1av2A-5ms3A:
undetectable
1av2B-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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanotorris
formicicus) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		3 ALA A 166
VAL A 213
TRP A 229
 None
 0.80A 1av2A-5n28A:
undetectable
1av2B-5n28A:
undetectable		 1av2A-5n28A:
2.32
1av2B-5n28A:
2.32
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.
5nv3 RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Rhodobacter
sphaeroides) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  16
VAL A  71
TRP A  72
 None
 0.71A 1av2A-5nv3A:
undetectable
1av2B-5nv3A:
undetectable		 1av2A-5nv3A:
3.90
1av2B-5nv3A:
3.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o7g ALPHA/BETA HYDROLASE
FAMILY PROTEIN

(Bacillus
coagulans) 		no annotation 3 ALA A  71
VAL A  65
TRP A  80
 None
 0.89A 1av2A-5o7gA:
undetectable
1av2B-5o7gA:
undetectable		 1av2A-5o7gA:
undetectable
1av2B-5o7gA:
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.
5okz EXOSOME COMPLEX
COMPONENT RRP4

(Saccharomyces
cerevisiae) 		PF14382
(ECR1_N)
PF15985
(KH_6) 		3 ALA H 117
VAL H 119
TRP H 124
 None
 0.87A 1av2A-5okzH:
undetectable
1av2B-5okzH:
undetectable		 1av2A-5okzH:
5.08
1av2B-5okzH:
5.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tkm DNA DC->DU-EDITING
ENZYME APOBEC-3B

(Homo sapiens) 		PF08210
(APOBEC_N) 		3 ALA A  67
VAL A  59
TRP A  94
 None
 0.85A 1av2A-5tkmA:
undetectable
1av2B-5tkmA:
undetectable		 1av2A-5tkmA:
6.54
1av2B-5tkmA:
6.54
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.
5u0s MEDIATOR COMPLEX
SUBUNIT 8
MEDIATOR COMPLEX
SUBUNIT 18

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF10232
(Med8)
PF09637
(Med18) 		3 ALA H 184
VAL R  10
TRP R 165
 None
 0.93A 1av2A-5u0sH:
undetectable
1av2B-5u0sH:
undetectable		 1av2A-5u0sH:
6.20
1av2B-5u0sH:
6.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u1o GLUTATHIONE
REDUCTASE

(Vibrio
parahaemolyticus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 ALA A 187
VAL A 189
TRP A  58
 None
 0.97A 1av2A-5u1oA:
undetectable
1av2B-5u1oA:
undetectable		 1av2A-5u1oA:
12.50
1av2B-5u1oA:
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.
5uld TRANSPORTER, NADC
FAMILY

(Vibrio cholerae) 		PF00939
(Na_sulph_symp) 		3 ALA A  63
VAL A  66
TRP A  59
 None
 0.79A 1av2A-5uldA:
undetectable
1av2B-5uldA:
undetectable		 1av2A-5uldA:
2.97
1av2B-5uldA:
2.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		3 ALA A 272
VAL A 321
TRP A 305
 None
None
P5F  A1001 (-3.7A)
 0.89A 1av2A-5ur2A:
undetectable
1av2B-5ur2A:
undetectable		 1av2A-5ur2A:
2.82
1av2B-5ur2A:
2.82
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.
5vf4 UNCHARACTERIZED
PROTEIN

(Thermus
aquaticus) 		PF03781
(FGE-sulfatase) 		3 ALA A  90
VAL A 373
TRP A 201
 None
 0.85A 1av2A-5vf4A:
undetectable
1av2B-5vf4A:
undetectable		 1av2A-5vf4A:
6.06
1av2B-5vf4A:
6.06
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.
5xsx CHITINASE

(Thermococcus
chitonophagus) 		no annotation 3 ALA A 646
VAL A 680
TRP A 682
 None
 0.89A 1av2A-5xsxA:
undetectable
1av2B-5xsxA:
undetectable		 1av2A-5xsxA:
undetectable
1av2B-5xsxA:
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.
5yim SDEA

(Legionella
pneumophila) 		no annotation 3 ALA A 399
VAL A 401
TRP A 394
 None
 0.73A 1av2A-5yimA:
undetectable
1av2B-5yimA:
undetectable		 1av2A-5yimA:
undetectable
1av2B-5yimA:
undetectable