SIMILAR PATTERNS OF AMINO ACIDS FOR 2V32_D_BEZD1221_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.
1e3d [NIFE] HYDROGENASE
LARGE SUBUNIT

(Desulfovibrio
desulfuricans) 		PF00374
(NiFeSe_Hases) 		5 VAL B 331
PRO B 498
SER B 506
GLU B 329
ARG B 368
 None
None
None
MG  B 901 ( 3.9A)
None
 1.29A 2v32C-1e3dB:
undetectable
2v32D-1e3dB:
undetectable		 2v32C-1e3dB:
17.95
2v32D-1e3dB:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eb3 5-AMINOLAEVULINIC
ACID DEHYDRATASE

(Saccharomyces
cerevisiae) 		PF00490
(ALAD) 		4 VAL A  91
PRO A  92
PRO A 111
VAL A 112
 None
 0.97A 2v32C-1eb3A:
undetectable
2v32D-1eb3A:
undetectable		 2v32C-1eb3A:
23.19
2v32D-1eb3A:
23.19
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.
1iyl MYRISTOYL-COA:PROTEI
N
N-MYRISTOYLTRANSFERA
SE

(Candida
albicans) 		PF01233
(NMT)
PF02799
(NMT_C) 		4 PRO A 130
THR A 156
PRO A 157
VAL A 158
 None
 0.94A 2v32C-1iylA:
undetectable
2v32D-1iylA:
undetectable		 2v32C-1iylA:
20.00
2v32D-1iylA:
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 PRO A 385
VAL A 141
SER A 140
GLU A  78
 None
 0.96A 2v32C-1mb9A:
undetectable
2v32D-1mb9A:
undetectable		 2v32C-1mb9A:
19.84
2v32D-1mb9A:
19.84
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.
1nd7 WW DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00632
(HECT) 		4 THR A 575
VAL A 571
SER A 572
ARG A 601
 None
 0.92A 2v32C-1nd7A:
undetectable
2v32D-1nd7A:
undetectable		 2v32C-1nd7A:
20.26
2v32D-1nd7A:
20.26
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.
1rw9 CHONDROITIN AC LYASE

(Paenarthrobacter
aurescens) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		4 PRO A 684
THR A 704
PRO A 703
GLU A 473
 None
 0.94A 2v32C-1rw9A:
undetectable
2v32D-1rw9A:
undetectable		 2v32C-1rw9A:
14.97
2v32D-1rw9A:
14.97
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.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN

(Aquifex
aeolicus) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 VAL A 294
PRO A 297
VAL A 298
SER A 299
 None
 0.98A 2v32C-1ulzA:
undetectable
2v32D-1ulzA:
undetectable		 2v32C-1ulzA:
18.75
2v32D-1ulzA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		4 THR A 254
VAL A 251
SER A 250
GLU A 217
 None
 0.78A 2v32C-1ur4A:
undetectable
2v32D-1ur4A:
undetectable		 2v32C-1ur4A:
21.04
2v32D-1ur4A:
21.04
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.
1wta 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Aeropyrum
pernix) 		PF01048
(PNP_UDP_1) 		4 VAL A  91
THR A 213
SER A  95
ARG A  62
 None
None
PO4  A 400 (-2.8A)
PO4  A 400 (-3.8A)
 0.80A 2v32C-1wtaA:
undetectable
2v32D-1wtaA:
undetectable		 2v32C-1wtaA:
23.21
2v32D-1wtaA:
23.21
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.
1xmj CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		4 THR A 438
PRO A 439
VAL A 440
GLU A 621
 None
None
ATP  A   1 (-4.8A)
None
 0.93A 2v32C-1xmjA:
undetectable
2v32D-1xmjA:
undetectable		 2v32C-1xmjA:
21.73
2v32D-1xmjA:
21.73
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.
1y25 PROBABLE THIOL
PEROXIDASE

(Mycobacterium
tuberculosis) 		PF08534
(Redoxin) 		5 THR A  57
PRO A  58
VAL A  59
SER A  60
ARG A 130
 ACT  A1200 (-3.6A)
ACT  A1200 (-3.6A)
ACT  A1200 (-3.7A)
ACT  A1200 (-2.8A)
ACT  A1200 (-3.1A)
 0.32A 2v32C-1y25A:
16.6
2v32D-1y25A:
17.4		 2v32C-1y25A:
25.11
2v32D-1y25A:
25.11
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.
1yzp PEROXIDASE
MANGANESE-DEPENDENT
I

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 THR A 193
PRO A 194
VAL A 175
SER A 174
 CA  A 371 (-3.6A)
None
None
CA  A 371 (-2.4A)
 0.99A 2v32C-1yzpA:
undetectable
2v32D-1yzpA:
undetectable		 2v32C-1yzpA:
20.83
2v32D-1yzpA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zmb ACETYLXYLAN ESTERASE
RELATED ENZYME

(Clostridium
acetobutylicum) 		PF03629
(SASA) 		4 PRO A  50
VAL A  51
SER A  52
ARG A  16
 None
 0.86A 2v32C-1zmbA:
undetectable
2v32D-1zmbA:
undetectable		 2v32C-1zmbA:
21.97
2v32D-1zmbA:
21.97
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.
2a4v PEROXIREDOXIN DOT5

(Saccharomyces
cerevisiae) 		PF00578
(AhpC-TSA) 		4 THR A 104
PRO A 105
SER A 107
ARG A 175
 None
 0.68A 2v32C-2a4vA:
18.1
2v32D-2a4vA:
20.6		 2v32C-2a4vA:
25.32
2v32D-2a4vA:
25.32
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.
2avt DNA POLYMERASE III
BETA SUBUNIT

(Streptococcus
pyogenes) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		4 VAL A 354
THR A 373
PRO A 374
VAL A 375
 None
 1.00A 2v32C-2avtA:
undetectable
2v32D-2avtA:
undetectable		 2v32C-2avtA:
20.86
2v32D-2avtA:
20.86
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.
2f5x BUGD

(Bordetella
pertussis) 		PF03401
(TctC) 		4 VAL A  11
PRO A  12
THR A  52
VAL A  55
 None
 0.98A 2v32C-2f5xA:
undetectable
2v32D-2f5xA:
undetectable		 2v32C-2f5xA:
21.05
2v32D-2f5xA:
21.05
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.
2iaz HYPOTHETICAL PROTEIN
SP1372

(Streptococcus
pneumoniae) 		PF06133
(Com_YlbF) 		4 VAL A 103
PRO A 106
VAL A 107
SER A 108
 None
 0.85A 2v32C-2iazA:
undetectable
2v32D-2iazA:
undetectable		 2v32C-2iazA:
21.03
2v32D-2iazA:
21.03
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.
2o74 OHCU DECARBOXYLASE

(Danio rerio) 		PF09349
(OHCU_decarbox) 		4 THR A  81
PRO A  82
SER A  84
ARG A 161
 None
None
GUN  A1001 (-2.9A)
None
 1.00A 2v32C-2o74A:
undetectable
2v32D-2o74A:
undetectable		 2v32C-2o74A:
23.08
2v32D-2o74A:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p87 PRE-MRNA-SPLICING
FACTOR PRP8

(Caenorhabditis
elegans) 		PF01398
(JAB)
PF08084
(PROCT) 		5 VAL A2141
PRO A2142
PRO A2267
VAL A2289
SER A2268
 None
 1.15A 2v32C-2p87A:
undetectable
2v32D-2p87A:
undetectable		 2v32C-2p87A:
18.06
2v32D-2p87A:
18.06
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.
2px7 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Thermus
thermophilus) 		PF01128
(IspD) 		5 VAL A 115
PRO A 116
THR A 146
VAL A  88
ARG A  70
 None
 1.42A 2v32C-2px7A:
undetectable
2v32D-2px7A:
undetectable		 2v32C-2px7A:
21.96
2v32D-2px7A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ri8 MANNOSYL-OLIGOSACCHA
RIDE
ALPHA-1,2-MANNOSIDAS
E

(Penicillium
citrinum) 		PF01532
(Glyco_hydro_47) 		4 THR A1066
PRO A1067
VAL A1068
SER A1069
 None
 0.45A 2v32C-2ri8A:
undetectable
2v32D-2ri8A:
undetectable		 2v32C-2ri8A:
19.08
2v32D-2ri8A:
19.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v41 PEROXIREDOXIN 6.

(Arenicola
marina) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		6 THR A  42
PRO A  43
VAL A  44
SER A  45
GLU A 117
ARG A 128
 BEZ  A1222 (-3.6A)
BEZ  A1222 (-3.2A)
BEZ  A1222 (-3.7A)
BEZ  A1222 (-3.0A)
BEZ  A1222 (-3.6A)
BEZ  A1222 (-3.3A)
 0.17A 2v32C-2v41A:
34.6
2v32D-2v41A:
34.6		 2v32C-2v41A:
100.00
2v32D-2v41A:
100.00
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.
2vqd BIOTIN CARBOXYLASE

(Pseudomonas
aeruginosa) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 VAL A 295
PRO A 298
VAL A 299
SER A 300
 None
 0.89A 2v32C-2vqdA:
undetectable
2v32D-2vqdA:
undetectable		 2v32C-2vqdA:
20.60
2v32D-2vqdA:
20.60
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.
2vx4 CELLVIBRIO JAPONICUS
MANNANASE CJMAN26C

(Cellvibrio
japonicus) 		PF02156
(Glyco_hydro_26) 		4 VAL A 173
PRO A 160
VAL A 161
SER A 162
 None
 0.99A 2v32C-2vx4A:
undetectable
2v32D-2vx4A:
undetectable		 2v32C-2vx4A:
20.20
2v32D-2vx4A:
20.20
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.
2wfc PEROXIREDOXIN 5

(Arenicola
marina) 		PF08534
(Redoxin) 		4 THR A  71
PRO A  72
SER A  74
ARG A 152
 None
 0.38A 2v32C-2wfcA:
18.5
2v32D-2wfcA:
19.8		 2v32C-2wfcA:
29.71
2v32D-2wfcA:
29.71
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.
2yb6 UBIQUITIN-CONJUGATIN
G ENZYME E2 B

(Homo sapiens) 		PF00179
(UQ_con) 		4 VAL A  22
PRO A  21
THR A 107
SER A 111
 None
 1.00A 2v32C-2yb6A:
undetectable
2v32D-2yb6A:
undetectable		 2v32C-2yb6A:
18.86
2v32D-2yb6A:
18.86
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.
2yew E2 ENVELOPE
GLYCOPROTEIN

(Barmah Forest
virus) 		PF00943
(Alpha_E2_glycop) 		4 VAL C 172
PRO C 173
PRO C 242
VAL C 241
 None
 0.96A 2v32C-2yewC:
undetectable
2v32D-2yewC:
undetectable		 2v32C-2yewC:
18.33
2v32D-2yewC:
18.33
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.
2yvt HYPOTHETICAL PROTEIN
AQ_1956

(Aquifex
aeolicus) 		PF14582
(Metallophos_3) 		4 VAL A 221
THR A 182
PRO A 183
SER A 201
 None
 0.96A 2v32C-2yvtA:
undetectable
2v32D-2yvtA:
undetectable		 2v32C-2yvtA:
25.27
2v32D-2yvtA:
25.27
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.
2yzh PROBABLE THIOL
PEROXIDASE

(Aquifex
aeolicus) 		PF08534
(Redoxin) 		4 THR A  58
PRO A  59
VAL A  60
ARG A 132
 None
 0.66A 2v32C-2yzhA:
15.7
2v32D-2yzhA:
17.5		 2v32C-2yzhA:
25.43
2v32D-2yzhA:
25.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2z9s PEROXIREDOXIN-1

(Rattus
norvegicus) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  49
VAL A  51
SER A  52
ARG A 128
 None
 0.36A 2v32C-2z9sA:
22.5
2v32D-2z9sA:
22.6		 2v32C-2z9sA:
30.17
2v32D-2z9sA:
30.17
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.
2ztg ALANYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		4 VAL A 260
THR A 138
VAL A 135
SER A 134
 None
 0.84A 2v32C-2ztgA:
undetectable
2v32D-2ztgA:
undetectable		 2v32C-2ztgA:
15.36
2v32D-2ztgA:
15.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3a5w PROBABLE
PEROXIREDOXIN

(Aeropyrum
pernix) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  47
PRO A  48
VAL A  49
ARG A 126
 None
 0.22A 2v32C-3a5wA:
22.5
2v32D-3a5wA:
23.3		 2v32C-3a5wA:
33.20
2v32D-3a5wA:
33.20
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.
3afo NADH KINASE POS5

(Saccharomyces
cerevisiae) 		PF01513
(NAD_kinase) 		4 VAL A 165
PRO A 166
THR A 141
VAL A 138
 None
 0.62A 2v32C-3afoA:
undetectable
2v32D-3afoA:
2.7		 2v32C-3afoA:
21.07
2v32D-3afoA:
21.07
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.
3akf PUTATIVE SECRETED
ALPHA
L-ARABINOFURANOSIDAS
E II

(Streptomyces
avermitilis) 		PF04616
(Glyco_hydro_43)
PF05270
(AbfB) 		4 PRO A 177
THR A 127
PRO A 128
VAL A 129
 None
 0.79A 2v32C-3akfA:
undetectable
2v32D-3akfA:
undetectable		 2v32C-3akfA:
20.97
2v32D-3akfA:
20.97
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.
3al0 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT
C,LINKER,GLUTAMATE--
TRNA LIGASE 2

(Thermotoga
maritima;
synthetic
construct) 		PF00749
(tRNA-synt_1c)
PF02686
(Glu-tRNAGln) 		4 VAL C 344
PRO C 343
VAL C 131
GLU C 127
 None
 1.00A 2v32C-3al0C:
undetectable
2v32D-3al0C:
undetectable		 2v32C-3al0C:
17.20
2v32D-3al0C:
17.20
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.
3cei SUPEROXIDE DISMUTASE

(Helicobacter
pylori) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 VAL A 150
PRO A 151
THR A 143
PRO A 144
 None
 0.99A 2v32C-3ceiA:
undetectable
2v32D-3ceiA:
undetectable		 2v32C-3ceiA:
22.90
2v32D-3ceiA:
22.90
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.
3d9r KETOSTEROID
ISOMERASE-LIKE
PROTEIN

(Pectobacterium
atrosepticum) 		PF12680
(SnoaL_2) 		4 THR A  65
VAL A  62
SER A  61
ARG A  46
 None
 0.83A 2v32C-3d9rA:
undetectable
2v32D-3d9rA:
undetectable		 2v32C-3d9rA:
21.58
2v32D-3d9rA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3drn PEROXIREDOXIN,
BACTERIOFERRITIN
COMIGRATORY PROTEIN
HOMOLOG

(Sulfolobus
solfataricus) 		PF00578
(AhpC-TSA) 		4 THR A  42
PRO A  43
SER A  45
ARG A 112
 CIT  A 500 (-2.9A)
CIT  A 500 (-3.6A)
CIT  A 500 (-2.5A)
CIT  A 500 (-3.7A)
 0.58A 2v32C-3drnA:
19.4
2v32D-3drnA:
22.0		 2v32C-3drnA:
27.78
2v32D-3drnA:
27.78
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.
3epd POLIOVIRUS RECEPTOR

(Homo sapiens) 		PF07686
(V-set)
PF08205
(C2-set_2) 		4 VAL R  53
PRO R  54
VAL R  31
ARG R 133
 None
 0.90A 2v32C-3epdR:
undetectable
2v32D-3epdR:
undetectable		 2v32C-3epdR:
20.65
2v32D-3epdR:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gsi N,N-DIMETHYLGLYCINE
OXIDASE

(Arthrobacter
globiformis) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		4 VAL A 774
THR A 704
SER A 701
ARG A 694
 None
 0.75A 2v32C-3gsiA:
undetectable
2v32D-3gsiA:
undetectable		 2v32C-3gsiA:
14.87
2v32D-3gsiA:
14.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hjp PEROXIREDOXIN,
BACTERIOFERRITIN
COMIGRATORY PROTEIN
HOMOLOG (BCP-4)

(Sulfolobus
solfataricus) 		PF00578
(AhpC-TSA) 		4 THR A  42
VAL A  44
SER A  45
ARG A 119
 CL  A 700 (-3.2A)
None
CL  A 700 (-3.0A)
CL  A 700 (-3.5A)
 0.47A 2v32C-3hjpA:
21.1
2v32D-3hjpA:
23.2		 2v32C-3hjpA:
26.81
2v32D-3hjpA:
26.81
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.
3hn0 NITRATE TRANSPORT
PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 THR A 252
PRO A 253
SER A 255
ARG A 258
 None
 1.00A 2v32C-3hn0A:
undetectable
2v32D-3hn0A:
undetectable		 2v32C-3hn0A:
21.58
2v32D-3hn0A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hp0 PUTATIVE POLYKETIDE
BIOSYNTHESIS
ENOYL-COA HYDRATASE
HOMOLOG PKSH

(Bacillus
subtilis) 		PF00378
(ECH_1) 		4 VAL A 102
THR A  52
VAL A  17
SER A  16
 None
 0.93A 2v32C-3hp0A:
undetectable
2v32D-3hp0A:
undetectable		 2v32C-3hp0A:
22.66
2v32D-3hp0A:
22.66
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		4 PRO 3 423
THR 3 430
PRO 3 431
GLU 3 287
 None
 0.82A 2v32C-3i9v3:
undetectable
2v32D-3i9v3:
undetectable		 2v32C-3i9v3:
16.09
2v32D-3i9v3:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m7a UNCHARACTERIZED
PROTEIN

(Novosphingobium
aromaticivorans) 		PF02643
(DUF192) 		5 PRO A  41
VAL A  42
SER A  43
GLU A  86
ARG A  79
 None
 1.17A 2v32C-3m7aA:
undetectable
2v32D-3m7aA:
undetectable		 2v32C-3m7aA:
22.51
2v32D-3m7aA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n0t DIPEPTIDYL PEPTIDASE
2

(Homo sapiens) 		PF05577
(Peptidase_S28) 		4 PRO A 275
PRO A 455
VAL A 458
ARG A 462
 None
 0.97A 2v32C-3n0tA:
undetectable
2v32D-3n0tA:
undetectable		 2v32C-3n0tA:
19.57
2v32D-3n0tA:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nz4 PHENYLALANINE
AMMONIA-LYASE

(Taxus
canadensis) 		PF00221
(Lyase_aromatic) 		4 VAL A 167
PRO A 168
VAL A 195
SER A 194
 None
 0.96A 2v32C-3nz4A:
undetectable
2v32D-3nz4A:
undetectable		 2v32C-3nz4A:
15.31
2v32D-3nz4A:
15.31
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 4 THR L 247
PRO L 248
VAL L 249
SER L 250
 None
 0.89A 2v32C-3rkoL:
undetectable
2v32D-3rkoL:
undetectable		 2v32C-3rkoL:
15.99
2v32D-3rkoL:
15.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sbc PEROXIREDOXIN TSA1

(Saccharomyces
cerevisiae) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  44
VAL A  46
SER A  47
ARG A 123
 None
 0.37A 2v32C-3sbcA:
21.2
2v32D-3sbcA:
22.3		 2v32C-3sbcA:
24.69
2v32D-3sbcA:
24.69
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.
3sbg PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF12134
(PRP8_domainIV) 		4 VAL A2227
PRO A2228
PRO A2352
SER A2353
 None
 0.96A 2v32C-3sbgA:
2.2
2v32D-3sbgA:
undetectable		 2v32C-3sbgA:
17.76
2v32D-3sbgA:
17.76
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.
3sno HYPOTHETICAL
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF01063
(Aminotran_4) 		4 THR A 129
PRO A 130
VAL A 131
SER A 107
 None
 0.96A 2v32C-3snoA:
undetectable
2v32D-3snoA:
undetectable		 2v32C-3snoA:
20.67
2v32D-3snoA:
20.67
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.
3t2y SULFIDE-QUINONE
REDUCTASE, PUTATIVE

(Acidithiobacillus
ferrooxidans) 		PF07992
(Pyr_redox_2) 		4 THR A 312
PRO A 313
VAL A 314
GLU A 193
 None
 0.89A 2v32C-3t2yA:
undetectable
2v32D-3t2yA:
undetectable		 2v32C-3t2yA:
19.59
2v32D-3t2yA:
19.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tb2 1-CYS PEROXIREDOXIN

(Plasmodium
yoelii) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		5 THR A  44
PRO A  45
VAL A  46
GLU A 118
ARG A 129
 GOL  A 223 ( 4.3A)
GOL  A 223 (-3.6A)
GOL  A 223 (-3.7A)
GOL  A 223 (-3.4A)
GOL  A 223 (-4.1A)
 0.50A 2v32C-3tb2A:
30.0
2v32D-3tb2A:
30.2		 2v32C-3tb2A:
45.34
2v32D-3tb2A:
45.34
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.
3tl2 MALATE DEHYDROGENASE

(Bacillus
anthracis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 VAL A 127
PRO A 126
VAL A 304
SER A 303
 SCN  A 314 (-4.8A)
EDO  A 313 ( 3.7A)
SCN  A 314 ( 3.9A)
None
 0.94A 2v32C-3tl2A:
undetectable
2v32D-3tl2A:
2.3		 2v32C-3tl2A:
22.56
2v32D-3tl2A:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v94 CYCLIC NUCLEOTIDE
SPECIFIC
PHOSPHODIESTERASE

(Trypanosoma
cruzi) 		PF00233
(PDEase_I) 		4 PRO A 284
PRO A 427
VAL A 428
SER A 429
 None
 0.80A 2v32C-3v94A:
undetectable
2v32D-3v94A:
undetectable		 2v32C-3v94A:
20.17
2v32D-3v94A:
20.17
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.
3viu PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 2

(Thermus
thermophilus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		4 VAL A 544
THR A 484
VAL A 520
SER A 521
 None
None
None
ADP  A 800 (-4.5A)
 0.79A 2v32C-3viuA:
undetectable
2v32D-3viuA:
undetectable		 2v32C-3viuA:
16.00
2v32D-3viuA:
16.00
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 VAL B2227
PRO B2228
PRO B2352
SER B2353
 None
 0.93A 2v32C-3zefB:
2.2
2v32D-3zefB:
2.0		 2v32C-3zefB:
9.16
2v32D-3zefB:
9.16
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.
4af2 THIOL PEROXIDASE

(Escherichia
coli) 		PF08534
(Redoxin) 		4 THR A  58
VAL A  60
SER A  61
ARG A 133
 None
 0.28A 2v32C-4af2A:
16.7
2v32D-4af2A:
18.1		 2v32C-4af2A:
24.90
2v32D-4af2A:
24.90
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.
4dqd EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		4 THR A  96
PRO A  97
VAL A  98
SER A  99
 PPY  A 401 (-3.9A)
PPY  A 401 (-4.7A)
None
None
 0.86A 2v32C-4dqdA:
undetectable
2v32D-4dqdA:
undetectable		 2v32C-4dqdA:
21.25
2v32D-4dqdA:
21.25
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.
4fmc RORF2

(Escherichia
coli) 		PF06872
(EspG) 		5 VAL A  85
PRO A  84
THR A 341
SER A 366
ARG A 387
 None
 1.44A 2v32C-4fmcA:
undetectable
2v32D-4fmcA:
undetectable		 2v32C-4fmcA:
20.55
2v32D-4fmcA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g2b SECRETED EFFECTOR
PROTEIN SSEI

(Salmonella
enterica) 		PF15645
(Tox-PLDMTX) 		4 THR A 183
PRO A 184
VAL A 185
SER A 186
 None
 0.99A 2v32C-4g2bA:
undetectable
2v32D-4g2bA:
undetectable		 2v32C-4g2bA:
21.25
2v32D-4g2bA:
21.25
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		4 THR L 234
PRO L 235
VAL L 236
SER L 237
 None
 0.77A 2v32C-4heaL:
undetectable
2v32D-4heaL:
undetectable		 2v32C-4heaL:
14.52
2v32D-4heaL:
14.52
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.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		4 PRO A 163
VAL A 164
SER A 165
GLU A 205
 None
None
None
38I  A 406 ( 4.0A)
 0.95A 2v32C-4ixuA:
undetectable
2v32D-4ixuA:
undetectable		 2v32C-4ixuA:
20.87
2v32D-4ixuA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lis UDP-GLUCOSE
4-EPIMERASE

(Aspergillus
nidulans) 		PF16363
(GDP_Man_Dehyd) 		4 VAL A 216
PRO A 217
PRO A 213
ARG A 358
 None
 0.94A 2v32C-4lisA:
undetectable
2v32D-4lisA:
undetectable		 2v32C-4lisA:
19.79
2v32D-4lisA:
19.79
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.
4lk4 VESB PROTEASE

(Vibrio cholerae) 		PF00089
(Trypsin) 		4 VAL A 226
VAL A 256
SER A 257
GLU A 232
 None
 0.88A 2v32C-4lk4A:
undetectable
2v32D-4lk4A:
undetectable		 2v32C-4lk4A:
20.91
2v32D-4lk4A:
20.91
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.
4mae METHANOL
DEHYDROGENASE

(Methylacidiphilum
fumariolicum) 		PF13360
(PQQ_2) 		4 VAL A 403
PRO A 404
PRO A 470
GLU A 305
 None
 0.86A 2v32C-4maeA:
undetectable
2v32D-4maeA:
undetectable		 2v32C-4maeA:
17.47
2v32D-4maeA:
17.47
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.
4ncc FAB FRAGMENT HEAVY
FAB FRAGMENT LIGHT

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		4 PRO L  94
THR H  61
PRO H  62
SER H  63
 None
 0.79A 2v32C-4nccL:
undetectable
2v32D-4nccL:
undetectable		 2v32C-4nccL:
20.72
2v32D-4nccL:
20.72
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		4 VAL A 652
PRO A 653
VAL A 186
SER A 185
 None
 0.99A 2v32C-4qlbA:
2.7
2v32D-4qlbA:
3.1		 2v32C-4qlbA:
16.47
2v32D-4qlbA:
16.47
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.
4qu2 JMJC
DOMAIN-CONTAINING
PROTEIN 7

(Mus musculus) 		PF13621
(Cupin_8) 		4 VAL A  29
PRO A  30
PRO A  26
VAL A  25
 None
 0.95A 2v32C-4qu2A:
undetectable
2v32D-4qu2A:
undetectable		 2v32C-4qu2A:
21.98
2v32D-4qu2A:
21.98
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		4 THR A 244
PRO A 245
VAL A 242
SER A 243
 None
 0.93A 2v32C-4ru0A:
undetectable
2v32D-4ru0A:
undetectable		 2v32C-4ru0A:
18.22
2v32D-4ru0A:
18.22
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.
4uyb SEC14-LIKE PROTEIN 3

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		4 THR A 398
PRO A 399
VAL A 400
GLU A 156
 None
None
None
EDO  A1401 ( 4.4A)
 0.98A 2v32C-4uybA:
undetectable
2v32D-4uybA:
undetectable		 2v32C-4uybA:
19.55
2v32D-4uybA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yio SUPEROXIDE DISMUTASE

(Streptococcus
thermophilus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 PRO A 157
THR A 149
PRO A 150
SER A 152
GLU A  53
 None
 1.28A 2v32C-4yioA:
undetectable
2v32D-4yioA:
undetectable		 2v32C-4yioA:
21.96
2v32D-4yioA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yip SUPEROXIDE DISMUTASE
[MN/FE]

(Streptococcus
mutans) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 THR A 149
PRO A 150
SER A 152
GLU A  53
 None
 1.00A 2v32C-4yipA:
undetectable
2v32D-4yipA:
undetectable		 2v32C-4yipA:
24.30
2v32D-4yipA:
24.30
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.
4ynv ACL4

(Chaetomium
thermophilum) 		PF13432
(TPR_16) 		4 VAL A 251
PRO A 252
PRO A 211
SER A 237
 None
 0.84A 2v32C-4ynvA:
undetectable
2v32D-4ynvA:
undetectable		 2v32C-4ynvA:
20.70
2v32D-4ynvA:
20.70
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.
5b5z PTLCIB4 H88A MUTANT

(Phaeodactylum
tricornutum) 		no annotation 4 VAL A 194
PRO A 197
VAL A 198
SER A 199
 None
 0.70A 2v32C-5b5zA:
undetectable
2v32D-5b5zA:
undetectable		 2v32C-5b5zA:
21.95
2v32D-5b5zA:
21.95
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.
5c05 PUTATIVE
GAMMA-TERPINENE
SYNTHASE

(Thymus vulgaris) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		4 VAL A 448
THR A 454
PRO A 453
SER A 457
 VAL  A 448 ( 0.5A)
THR  A 454 ( 0.8A)
PRO  A 453 ( 1.1A)
SER  A 457 ( 0.0A)
 0.95A 2v32C-5c05A:
undetectable
2v32D-5c05A:
undetectable		 2v32C-5c05A:
17.32
2v32D-5c05A:
17.32
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.
5cj5 ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE

(Mycolicibacterium
thermoresistibile) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		4 THR A 107
PRO A 108
VAL A  25
GLU A 589
 None
 0.98A 2v32C-5cj5A:
undetectable
2v32D-5cj5A:
undetectable		 2v32C-5cj5A:
16.69
2v32D-5cj5A:
16.69
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.
5cwa ANTHRANILATE
SYNTHASE COMPONENT 1

(Mycobacterium
tuberculosis) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		4 VAL A 256
PRO A 257
VAL A 477
SER A 480
 None
 0.96A 2v32C-5cwaA:
undetectable
2v32D-5cwaA:
undetectable		 2v32C-5cwaA:
18.13
2v32D-5cwaA:
18.13
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.
5d3m ENERGY-COUPLING
FACTOR TRANSPORTER
ATP-BINDING PROTEIN
ECFA2

(Lactobacillus
delbrueckii) 		PF00005
(ABC_tran) 		5 PRO B  73
THR B  60
PRO B  59
VAL B   8
SER B   9
 None
 1.50A 2v32C-5d3mB:
undetectable
2v32D-5d3mB:
undetectable		 2v32C-5d3mB:
25.33
2v32D-5d3mB:
25.33
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.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		4 THR A 183
PRO A 184
SER A 186
ARG A 189
 ACT  A 307 (-3.1A)
None
ACT  A 307 (-3.1A)
ACT  A 307 (-3.4A)
 0.90A 2v32C-5e43A:
undetectable
2v32D-5e43A:
undetectable		 2v32C-5e43A:
20.32
2v32D-5e43A:
20.32
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.
5h1k GEM-ASSOCIATED
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 PRO A 631
THR A 634
VAL A 608
SER A 636
 None
 0.96A 2v32C-5h1kA:
undetectable
2v32D-5h1kA:
undetectable		 2v32C-5h1kA:
17.39
2v32D-5h1kA:
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.
5j9c PEROXIREDOXIN ASP F3

(Aspergillus
fumigatus) 		PF08534
(Redoxin) 		5 THR A  58
PRO A  59
VAL A  60
SER A  61
ARG A 134
 None
 0.28A 2v32C-5j9cA:
17.5
2v32D-5j9cA:
18.9		 2v32C-5j9cA:
25.00
2v32D-5j9cA:
25.00
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.
5m59 PUTATIVE PRE-MRNA
SPLICING FACTOR

(Chaetomium
thermophilum) 		PF08084
(PROCT) 		4 VAL B2121
PRO B2122
PRO B2249
VAL B2273
 None
 0.86A 2v32C-5m59B:
undetectable
2v32D-5m59B:
undetectable		 2v32C-5m59B:
20.68
2v32D-5m59B:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nd1 CAPSID PROTEIN
CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1;
Rosellinia
necatrix
quadrivirus 1) 		no annotation
no annotation 		4 VAL B 551
PRO B 552
THR B 530
ARG A 833
 None
 0.80A 2v32C-5nd1B:
undetectable
2v32D-5nd1B:
undetectable		 2v32C-5nd1B:
undetectable
2v32D-5nd1B:
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.
5npx POLYPROTEIN

(Broad bean
stain virus) 		no annotation 4 THR S 430
PRO S 431
VAL S 432
SER S 433
 None
 0.87A 2v32C-5npxS:
undetectable
2v32D-5npxS:
undetectable		 2v32C-5npxS:
undetectable
2v32D-5npxS:
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.
5ori ALBUMIN

(Capra hircus) 		no annotation 4 VAL A 297
PRO A 298
PRO A 223
SER A 219
 None
 0.77A 2v32C-5oriA:
undetectable
2v32D-5oriA:
undetectable		 2v32C-5oriA:
16.01
2v32D-5oriA:
16.01
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.
5u2u HEAT SHOCK PROTEIN
104

(Saccharomyces
cerevisiae) 		PF02861
(Clp_N) 		4 VAL A  48
PRO A  49
THR A  42
PRO A  43
 None
 0.86A 2v32C-5u2uA:
undetectable
2v32D-5u2uA:
undetectable		 2v32C-5u2uA:
20.76
2v32D-5u2uA:
20.76
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.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		4 VAL A 820
PRO A 819
PRO A 515
SER A 518
 None
 0.98A 2v32C-5ur2A:
2.7
2v32D-5ur2A:
2.1		 2v32C-5ur2A:
12.63
2v32D-5ur2A:
12.63
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.
5xbq PEROXIREDOXIN

(Pyrococcus
horikoshii) 		no annotation 4 THR A  43
PRO A  44
VAL A  45
ARG A 121
 OCS  A  46 ( 3.6A)
None
OCS  A  46 ( 3.0A)
OCS  A  46 ( 2.3A)
 0.58A 2v32C-5xbqA:
24.4
2v32D-5xbqA:
25.7		 2v32C-5xbqA:
undetectable
2v32D-5xbqA:
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.
5xfa NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus) 		PF00374
(NiFeSe_Hases) 		4 VAL D 188
PRO D 189
PRO D  73
VAL D  74
 None
 0.78A 2v32C-5xfaD:
undetectable
2v32D-5xfaD:
undetectable		 2v32C-5xfaD:
19.36
2v32D-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yq7 CYTOCHROME SUBUNIT
OF PHOTOSYNTHETIC
REACTION CENTER
PRECURSOR FOR M
SUBUNITS OF
PHOTOSYNTHETIC
REACTION CENTER

(Roseiflexus
castenholzii;
Roseiflexus
castenholzii) 		no annotation
no annotation 		4 THR M 422
PRO M 421
SER M 495
GLU C 221
 None
 0.93A 2v32C-5yq7M:
undetectable
2v32D-5yq7M:
undetectable		 2v32C-5yq7M:
undetectable
2v32D-5yq7M:
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.
5zq4 SIDE

(Legionella
pneumophila) 		no annotation 4 VAL B 315
PRO B 224
VAL B 223
SER B 222
 None
 1.00A 2v32C-5zq4B:
undetectable
2v32D-5zq4B:
undetectable		 2v32C-5zq4B:
undetectable
2v32D-5zq4B:
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.
6amn HEAT SHOCK PROTEIN
104

(Saccharomyces
cerevisiae) 		no annotation 4 VAL A  48
PRO A  49
THR A  42
PRO A  43
 None
 0.80A 2v32C-6amnA:
undetectable
2v32D-6amnA:
undetectable		 2v32C-6amnA:
undetectable
2v32D-6amnA:
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.
6b5v TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5

(Oryctolagus
cuniculus) 		no annotation 4 THR A 311
PRO A 312
VAL A 313
GLU A 309
 None
 0.98A 2v32C-6b5vA:
undetectable
2v32D-6b5vA:
undetectable		 2v32C-6b5vA:
undetectable
2v32D-6b5vA:
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.
6c62 BIURET HYDROLASE

(Pseudomonas sp.
ADP) 		no annotation 4 PRO A 403
VAL A 404
SER A 405
ARG A 176
 None
 0.74A 2v32C-6c62A:
undetectable
2v32D-6c62A:
undetectable		 2v32C-6c62A:
undetectable
2v32D-6c62A:
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.
6con COA-TRANSFERASE
SUBUNIT BETA

(Mycobacterium
tuberculosis) 		no annotation 4 VAL B 237
PRO B 240
SER B 242
ARG B 244
 None
 0.96A 2v32C-6conB:
undetectable
2v32D-6conB:
undetectable		 2v32C-6conB:
undetectable
2v32D-6conB:
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.
6eu6 AMMONIUM TRANSPORTER

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 4 THR A 288
PRO A 289
VAL A 290
SER A 291
 None
 0.81A 2v32C-6eu6A:
undetectable
2v32D-6eu6A:
undetectable		 2v32C-6eu6A:
undetectable
2v32D-6eu6A:
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.
6eyu BACTERIORHODOPSIN

(Candidatus
Nanosalina sp.
J07AB43) 		no annotation 4 THR A  81
PRO A  82
VAL A  79
SER A  80
 RET  A 301 (-4.4A)
None
MUN  A 310 ( 4.7A)
RET  A 301 ( 4.2A)
 0.89A 2v32C-6eyuA:
undetectable
2v32D-6eyuA:
undetectable		 2v32C-6eyuA:
undetectable
2v32D-6eyuA:
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.
6g42 MINOR CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus) 		no annotation 5 PRO A 284
PRO A  27
VAL A  28
SER A  29
GLU A 203
 None
 1.49A 2v32C-6g42A:
undetectable
2v32D-6g42A:
undetectable		 2v32C-6g42A:
undetectable
2v32D-6g42A:
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.
6gww PEROXIREDOXIN

(Sulfolobus
islandicus) 		no annotation 4 THR A  46
PRO A  47
VAL A  48
ARG A 125
 CSO  A  49 ( 3.3A)
None
CSO  A  49 ( 3.0A)
CSO  A  49 ( 3.1A)
 0.25A 2v32C-6gwwA:
24.4
2v32D-6gwwA:
26.2		 2v32C-6gwwA:
undetectable
2v32D-6gwwA:
undetectable