SIMILAR PATTERNS OF AMINO ACIDS FOR 4QTU_B_SAMB301_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.
1ahi 7
ALPHA-HYDROXYSTEROID
DEHYDROGENASE


(Escherichia
coli)
PF13561
(adh_short_C2)
5 GLY A  18
GLY A  20
ILE A  43
ILE A  23
ARG A 113
NAI  A 302 (-3.6A)
NAI  A 302 ( 4.1A)
NAI  A 302 (-4.0A)
NAI  A 302 (-4.0A)
None
1.13A 4qtuB-1ahiA:
6.3
4qtuB-1ahiA:
20.96
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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)


(Pyrococcus
furiosus)
PF01314
(AFOR_C)
PF02730
(AFOR_N)
5 GLY A  36
GLY A  34
ILE A  41
ALA A  39
ARG A 587
None
1.02A 4qtuB-1b25A:
undetectable
4qtuB-1b25A:
15.67
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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri)
PF01804
(Penicil_amidase)
5 GLY A  97
GLY A  93
ILE A   5
SER A  24
ALA A 100
None
1.13A 4qtuB-1cp9A:
undetectable
4qtuB-1cp9A:
23.32
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.
1f0p ANTIGEN 85-B

(Mycobacterium
tuberculosis)
PF00756
(Esterase)
5 GLY A  88
GLY A 173
SER A  76
ALA A  90
ARG A  20
None
1.07A 4qtuB-1f0pA:
undetectable
4qtuB-1f0pA:
23.18
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.
1gpj GLUTAMYL-TRNA
REDUCTASE


(Methanopyrus
kandleri)
PF00745
(GlutR_dimer)
PF01488
(Shikimate_DH)
PF05201
(GlutR_N)
5 GLY A 134
ILE A 143
SER A 144
ILE A 131
ALA A  89
None
1.14A 4qtuB-1gpjA:
5.5
4qtuB-1gpjA:
18.56
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.
1jp4 3'(2'),5'-BISPHOSPHA
TE NUCLEOTIDASE


(Rattus
norvegicus)
PF00459
(Inositol_P)
5 TYR A 272
GLY A 148
GLY A 138
ILE A 146
ILE A 150
None
0.86A 4qtuB-1jp4A:
undetectable
4qtuB-1jp4A:
21.18
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.
1kph CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 1


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
5 GLY A  74
GLY A  72
LEU A  95
ILE A 136
SER A 135
SAH  A1900 (-3.2A)
SAH  A1900 (-3.1A)
SAH  A1900 (-4.4A)
SAH  A1900 (-4.2A)
None
1.10A 4qtuB-1kphA:
17.0
4qtuB-1kphA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kph CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 1


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
6 TYR A  16
GLY A  72
GLY A  74
SER A  96
ILE A 136
ALA A 138
SAH  A1900 ( 4.2A)
SAH  A1900 (-3.1A)
SAH  A1900 (-3.2A)
None
SAH  A1900 (-4.2A)
SAH  A1900 (-3.2A)
0.85A 4qtuB-1kphA:
17.0
4qtuB-1kphA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l1e MYCOLIC ACID
SYNTHASE


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
6 GLY A  72
GLY A  74
SER A  96
ILE A 136
ALA A 138
ARG A 146
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-3.9A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.6A)
0.87A 4qtuB-1l1eA:
16.7
4qtuB-1l1eA:
22.30
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.
1l1e MYCOLIC ACID
SYNTHASE


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
5 GLY A  74
GLY A  72
LEU A  95
ILE A 136
SER A 135
SAH  A 900 (-3.4A)
SAH  A 900 (-3.1A)
SAH  A 900 (-4.1A)
SAH  A 900 (-3.9A)
None
1.11A 4qtuB-1l1eA:
16.7
4qtuB-1l1eA:
22.30
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.
1ldi GLYCEROL UPTAKE
FACILITATOR PROTEIN


(Escherichia
coli)
PF00230
(MIP)
5 GLY A 247
GLY A 243
ILE A 158
MET A 153
ALA A 250
None
0.97A 4qtuB-1ldiA:
undetectable
4qtuB-1ldiA:
20.21
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.
1nkv HYPOTHETICAL PROTEIN
YJHP


(Escherichia
coli)
PF13847
(Methyltransf_31)
5 GLY A  44
GLY A  46
SER A  68
ALA A 112
TRP A 114
None
0.79A 4qtuB-1nkvA:
13.8
4qtuB-1nkvA:
23.72
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.
1p91 RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A


(Escherichia
coli)
PF13847
(Methyltransf_31)
5 GLY A  93
GLY A  95
SER A 118
ILE A 155
ALA A 157
None
SAM  A1401 (-3.4A)
None
SAM  A1401 (-4.2A)
None
0.64A 4qtuB-1p91A:
15.7
4qtuB-1p91A:
21.79
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.
1ps9 2,4-DIENOYL-COA
REDUCTASE


(Escherichia
coli)
PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2)
6 GLY A 385
GLY A 380
LEU A 461
ILE A 408
ILE A 460
ALA A 389
None
FAD  A 701 (-2.9A)
None
None
None
None
1.27A 4qtuB-1ps9A:
undetectable
4qtuB-1ps9A:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sfr ANTIGEN 85-A

(Mycobacterium
tuberculosis)
PF00756
(Esterase)
5 GLY A  88
GLY A 173
SER A  76
ALA A  90
ARG A  20
None
1.03A 4qtuB-1sfrA:
undetectable
4qtuB-1sfrA:
23.13
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.
1tpy METHOXY MYCOLIC ACID
SYNTHASE 2


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
5 GLY A  72
GLY A  74
SER A  96
ILE A 136
ALA A 138
SAH  A1900 (-3.2A)
SAH  A1900 (-3.3A)
None
SAH  A1900 (-3.6A)
SAH  A1900 (-3.1A)
0.48A 4qtuB-1tpyA:
17.2
4qtuB-1tpyA:
21.43
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER


(Escherichia
coli)
PF00909
(Ammonium_transp)
5 GLY A 268
GLY A 292
ILE A 242
ILE A 287
ALA A 237
None
1.05A 4qtuB-1u7gA:
undetectable
4qtuB-1u7gA:
19.95
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226


(Pyrococcus
horikoshii)
PF13649
(Methyltransf_25)
5 GLY A  48
ILE A  68
SER A  69
MET A  72
ILE A 110
SAM  A 302 (-3.6A)
SAM  A 302 (-3.7A)
SAM  A 302 (-4.7A)
SAM  A 302 (-3.9A)
SAM  A 302 (-3.8A)
0.53A 4qtuB-1ve3A:
20.0
4qtuB-1ve3A:
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima)
PF00258
(Flavodoxin_1)
5 GLY A 229
GLY A 171
LEU A 224
ILE A  38
ILE A 231
None
1.11A 4qtuB-1vmeA:
undetectable
4qtuB-1vmeA:
18.05
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.
1xtp LMAJ004091AAA

(Leishmania
major)
PF05891
(Methyltransf_PK)
5 GLY A 101
GLY A 103
MET A 128
MET A 149
ILE A 107
SAI  A 401 (-3.4A)
SAI  A 401 (-3.2A)
SAI  A 401 ( 4.9A)
SAI  A 401 (-4.4A)
SAI  A 401 (-4.9A)
1.09A 4qtuB-1xtpA:
15.5
4qtuB-1xtpA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bpq ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE


(Mycobacterium
tuberculosis)
PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
5 GLY A 137
GLY A 146
LEU A 144
ILE A 158
ALA A 179
None
1.08A 4qtuB-2bpqA:
2.6
4qtuB-2bpqA:
19.58
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.
2ec5 DERMONECROTIC TOXIN

(Pasteurella
multocida)
PF11647
(MLD)
5 TYR A1018
GLY A1000
ILE A1023
ILE A 941
ALA A1041
None
1.14A 4qtuB-2ec5A:
undetectable
4qtuB-2ec5A:
15.05
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.
2fhp METHYLASE, PUTATIVE

(Enterococcus
faecalis)
PF03602
(Cons_hypoth95)
5 GLY A  51
GLY A  53
LEU A  13
ILE A  70
ALA A  76
None
0.92A 4qtuB-2fhpA:
12.2
4qtuB-2fhpA:
20.36
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.
2fk7 METHOXY MYCOLIC ACID
SYNTHASE 4


(Mycobacterium
tuberculosis)
PF02353
(CMAS)
5 GLY A  81
GLY A  83
SER A 105
ILE A 145
ALA A 147
None
0.61A 4qtuB-2fk7A:
15.0
4qtuB-2fk7A:
22.05
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.
2gqf HYPOTHETICAL PROTEIN
HI0933


(Haemophilus
influenzae)
PF03486
(HI0933_like)
5 GLY A  16
GLY A  11
ILE A  39
ILE A 161
ALA A  20
None
FAD  A 403 (-3.1A)
None
None
None
1.10A 4qtuB-2gqfA:
undetectable
4qtuB-2gqfA:
20.05
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.
2iht CARBOXYETHYLARGININE
SYNTHASE


(Streptomyces
clavuligerus)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 GLY A 441
ILE A 410
SER A 437
ILE A 446
ALA A 444
None
TPP  A 600 (-4.5A)
TPP  A 600 (-3.5A)
None
None
1.12A 4qtuB-2ihtA:
undetectable
4qtuB-2ihtA:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pby GLUTAMINASE

(Geobacillus
kaustophilus)
PF04960
(Glutaminase)
5 GLY A 292
GLY A 280
ILE A  42
SER A  41
ALA A  16
None
1.12A 4qtuB-2pbyA:
undetectable
4qtuB-2pbyA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q0f RNA URIDYLYL
TRANSFERASE


(Trypanosoma
brucei)
PF03828
(PAP_assoc)
5 GLY A 184
GLY A 176
ILE A 182
ILE A 186
ALA A 179
None
1.15A 4qtuB-2q0fA:
undetectable
4qtuB-2q0fA:
20.73
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.
3au7 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Archaeoglobus
fulgidus)
PF01336
(tRNA_anti-codon)
PF08489
(DUF1743)
5 GLY A 141
GLY A 144
LEU A 117
ILE A   7
ILE A 119
None
1.02A 4qtuB-3au7A:
undetectable
4qtuB-3au7A:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b4w ALDEHYDE
DEHYDROGENASE


(Mycobacterium
tuberculosis)
PF00171
(Aldedh)
5 GLY A 417
GLY A 440
ILE A 434
SER A 431
ALA A 416
None
1.05A 4qtuB-3b4wA:
4.0
4qtuB-3b4wA:
18.64
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.
3bkw S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE


(Mesorhizobium
japonicum)
PF08241
(Methyltransf_11)
5 GLY A  50
GLY A  52
SER A  74
MET A  77
ALA A 115
None
0.80A 4qtuB-3bkwA:
17.3
4qtuB-3bkwA:
22.76
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE


(Exiguobacterium
sibiricum)
PF13649
(Methyltransf_25)
5 GLY A  40
GLY A  42
SER A  62
MET A  65
MET A  87
None
0.69A 4qtuB-3d2lA:
18.0
4qtuB-3d2lA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dli METHYLTRANSFERASE

(Archaeoglobus
fulgidus)
PF13489
(Methyltransf_23)
5 GLY A 290
GLY A 292
ILE A 312
MET A 316
ARG A 359
None
0.91A 4qtuB-3dliA:
18.2
4qtuB-3dliA:
24.10
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.
3ege PUTATIVE
METHYLTRANSFERASE
FROM ANTIBIOTIC
BIOSYNTHESIS PATHWAY


(Trichormus
variabilis)
PF08241
(Methyltransf_11)
6 GLY A  41
GLY A  43
SER A  64
MET A  67
ILE A 100
ALA A 102
EDO  A 261 (-3.2A)
EDO  A 261 ( 3.9A)
None
EDO  A 261 ( 4.1A)
None
EDO  A 261 ( 3.8A)
0.83A 4qtuB-3egeA:
15.8
4qtuB-3egeA:
22.22
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.
3f9t L-TYROSINE
DECARBOXYLASE MFNA


(Methanocaldococcus
jannaschii)
PF00282
(Pyridoxal_deC)
5 GLY A  94
GLY A 255
LEU A 257
SER A 253
ALA A 208
PLP  A 500 (-3.5A)
None
None
None
PLP  A 500 (-3.4A)
1.15A 4qtuB-3f9tA:
2.4
4qtuB-3f9tA:
17.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g5l PUTATIVE
S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE


(Listeria
monocytogenes)
PF13649
(Methyltransf_25)
5 GLY A  50
GLY A  52
SER A  74
MET A  77
ALA A 115
None
0.70A 4qtuB-3g5lA:
16.7
4qtuB-3g5lA:
25.37
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.
3hnr PROBABLE
METHYLTRANSFERASE
BT9727_4108


(Bacillus
thuringiensis)
PF08241
(Methyltransf_11)
5 GLY A  53
GLY A  55
SER A  76
MET A  79
ALA A 115
None
0.49A 4qtuB-3hnrA:
16.3
4qtuB-3hnrA:
24.47
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.
3il4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3


(Enterococcus
faecalis)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
5 GLY A 143
GLY A 168
LEU A 140
ILE A 286
ALA A  84
None
1.09A 4qtuB-3il4A:
3.0
4qtuB-3il4A:
25.08
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.
3ils AFLATOXIN
BIOSYNTHESIS
POLYKETIDE SYNTHASE


(Aspergillus
parasiticus)
PF00975
(Thioesterase)
5 GLY A1940
GLY A1934
MET A1870
ILE A2035
TRP A1936
None
1.06A 4qtuB-3ilsA:
undetectable
4qtuB-3ilsA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k4h PUTATIVE
TRANSCRIPTIONAL
REGULATOR


(Bacillus
cytotoxicus)
PF13377
(Peripla_BP_3)
5 GLY A 204
GLY A 179
SER A 175
ILE A 196
ALA A 198
None
0.94A 4qtuB-3k4hA:
2.5
4qtuB-3k4hA:
24.17
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.
3l49 ABC SUGAR (RIBOSE)
TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
SUBUNIT


(Rhodobacter
sphaeroides)
PF13407
(Peripla_BP_4)
5 GLY A 248
SER A 252
ILE A 221
ALA A 223
TRP A 225
None
None
None
None
UNL  A   1 ( 4.7A)
1.14A 4qtuB-3l49A:
3.6
4qtuB-3l49A:
22.44
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.
3l8d METHYLTRANSFERASE

(Bacillus
thuringiensis)
PF08241
(Methyltransf_11)
6 GLY A  61
GLY A  63
ILE A  83
SER A  84
MET A  87
ILE A 123
None
0.61A 4qtuB-3l8dA:
15.3
4qtuB-3l8dA:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l8k DIHYDROLIPOYL
DEHYDROGENASE


(Sulfolobus
solfataricus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 GLY A 179
LEU A 264
ILE A 207
ILE A 175
ALA A 178
None
1.04A 4qtuB-3l8kA:
2.5
4qtuB-3l8kA:
19.32
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.
3la4 UREASE

(Canavalia
ensiformis)
PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1)
5 GLY A 310
LEU A 308
ILE A 194
SER A 169
ILE A 148
None
1.09A 4qtuB-3la4A:
undetectable
4qtuB-3la4A:
12.37
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.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 GLY A  25
GLY A  21
SER A 211
MET A  93
ALA A  29
None
FDA  A 547 ( 4.7A)
None
None
None
1.03A 4qtuB-3ljpA:
undetectable
4qtuB-3ljpA:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lrh ANTI-HUNTINGTIN VL
DOMAIN


(Homo sapiens)
PF07686
(V-set)
5 GLY A 102
GLY A 104
SER A   7
ILE A  37
ALA A  89
None
1.09A 4qtuB-3lrhA:
undetectable
4qtuB-3lrhA:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m3p GLUTAMINE AMIDO
TRANSFERASE


(Methylobacillus
flagellatus)
PF00117
(GATase)
5 GLY A  87
LEU A 166
ILE A   9
MET A  55
ILE A 171
None
1.12A 4qtuB-3m3pA:
undetectable
4qtuB-3m3pA:
23.11
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.
3nks PROTOPORPHYRINOGEN
OXIDASE


(Homo sapiens)
PF01593
(Amino_oxidase)
5 GLY A 463
GLY A 448
LEU A 446
ILE A  12
ALA A  17
None
FAD  A 479 (-3.4A)
None
None
None
1.08A 4qtuB-3nksA:
2.4
4qtuB-3nksA:
17.56
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.
3qk7 TRANSCRIPTIONAL
REGULATORS


(Yersinia pestis)
PF00532
(Peripla_BP_1)
5 GLY A  95
ILE A 138
SER A 139
ILE A  70
ALA A  72
None
0.98A 4qtuB-3qk7A:
2.1
4qtuB-3qk7A:
22.22
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.
3tl2 MALATE DEHYDROGENASE

(Bacillus
anthracis)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 GLY A  12
GLY A  17
LEU A 238
ILE A  81
ALA A  83
EDO  A 315 ( 4.1A)
None
None
None
EDO  A 315 ( 3.7A)
1.12A 4qtuB-3tl2A:
5.0
4qtuB-3tl2A:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tu6 PSEUDOAZURIN (BLUE
COPPER PROTEIN)


(Sinorhizobium
meliloti)
PF00127
(Copper-bind)
5 TYR A 108
GLY A  90
LEU A  46
SER A 112
ILE A  92
None
1.13A 4qtuB-3tu6A:
undetectable
4qtuB-3tu6A:
22.97
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.
3upy OXIDOREDUCTASE

(Brucella
abortus)
PF03447
(NAD_binding_3)
5 TYR A 161
GLY A 121
GLY A 125
ILE A 425
ALA A 142
None
1.08A 4qtuB-3upyA:
3.9
4qtuB-3upyA:
18.89
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.
3vi3 INTEGRIN ALPHA-5

(Homo sapiens)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
5 GLY A  20
GLY A  38
LEU A  36
ILE A 434
ALA A 443
None
1.08A 4qtuB-3vi3A:
undetectable
4qtuB-3vi3A:
16.18
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.
3vqr PUTATIVE
OXIDOREDUCTASE


(Aeropyrum
pernix)
PF01266
(DAO)
5 GLY A  45
GLY A  40
LEU A  16
ALA A 160
ARG A 256
None
1.06A 4qtuB-3vqrA:
3.0
4qtuB-3vqrA:
17.07
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.
3wwh (R)-AMINE
TRANSAMINASE


(Arthrobacter
sp. KNK168)
PF01063
(Aminotran_4)
5 TYR A 148
GLY A  59
LEU A  61
ILE A 127
SER A 126
None
1.02A 4qtuB-3wwhA:
undetectable
4qtuB-3wwhA:
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.
4aty TEREPHTHALATE
1,2-CIS-DIHYDRODIOL
DEHYDROGENASE


(Paraburkholderia
xenovorans)
PF04166
(PdxA)
5 TYR A 159
GLY A 319
GLY A 317
LEU A 335
ILE A  25
None
1.12A 4qtuB-4atyA:
2.6
4qtuB-4atyA:
19.48
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.
4b4u BIFUNCTIONAL PROTEIN
FOLD


(Acinetobacter
baumannii)
PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C)
5 GLY A 230
GLY A 210
LEU A 214
ILE A 242
ALA A 229
None
NAP  A1001 ( 3.9A)
NAP  A1001 (-4.6A)
None
None
1.10A 4qtuB-4b4uA:
2.6
4qtuB-4b4uA:
23.47
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.
4bo6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE FABG


(Pseudomonas
aeruginosa)
PF13561
(adh_short_C2)
5 GLY A  12
GLY A  34
LEU A  59
ILE A  21
ALA A  90
None
1.14A 4qtuB-4bo6A:
6.3
4qtuB-4bo6A:
24.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fc7 PEROXISOMAL
2,4-DIENOYL-COA
REDUCTASE


(Homo sapiens)
PF13561
(adh_short_C2)
5 GLY A  35
GLY A  37
SER A  61
ILE A  40
ARG A  88
NAP  A 401 (-3.5A)
NAP  A 401 ( 4.9A)
NAP  A 401 (-4.4A)
NAP  A 401 (-4.0A)
COA  A 402 ( 2.8A)
1.13A 4qtuB-4fc7A:
6.4
4qtuB-4fc7A:
24.15
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.
4fk1 PUTATIVE THIOREDOXIN
REDUCTASE


(Bacillus
anthracis)
PF07992
(Pyr_redox_2)
5 GLY C  15
GLY C  12
LEU C 278
ILE C   9
ALA C 267
None
FAD  C 500 (-3.2A)
FAD  C 500 (-3.7A)
None
None
0.99A 4qtuB-4fk1C:
3.1
4qtuB-4fk1C:
19.43
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.
4i0w PROTEASE CSPB

(Clostridium
perfringens)
PF00082
(Peptidase_S8)
5 GLY B 502
LEU B 247
ILE B 190
ILE B 120
ALA B 205
None
1.03A 4qtuB-4i0wB:
undetectable
4qtuB-4i0wB:
19.62
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans)
PF08241
(Methyltransf_11)
5 TYR A 187
GLY A 232
GLY A 234
SER A 256
MET A 259
SAH  A 501 ( 4.1A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
SAH  A 501 (-4.5A)
SAH  A 501 (-3.9A)
0.62A 4qtuB-4ineA:
18.8
4qtuB-4ineA:
19.30
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.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE


(Plasmodium
knowlesi)
PF08241
(Methyltransf_11)
5 GLY A  61
GLY A  63
ILE A  84
MET A  88
ALA A 127
SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.4A)
0.73A 4qtuB-4iv8A:
18.4
4qtuB-4iv8A:
24.17
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2


(Haemonchus
contortus)
PF08241
(Methyltransf_11)
5 TYR A 183
GLY A 228
GLY A 230
SER A 252
MET A 255
SAH  A 701 ( 4.2A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
SAH  A 701 (-4.7A)
SAH  A 701 (-3.9A)
0.68A 4qtuB-4kriA:
19.2
4qtuB-4kriA:
20.05
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.
4lds BICYCLOMYCIN
RESISTANCE PROTEIN
TCAB


(Staphylococcus
epidermidis)
PF00083
(Sugar_tr)
5 GLY A  58
GLY A 106
ILE A  56
MET A  51
ILE A  78
None
1.13A 4qtuB-4ldsA:
undetectable
4qtuB-4ldsA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4msx PRE-MRNA-SPLICING
FACTOR SAD1


(Saccharomyces
cerevisiae)
PF00443
(UCH)
PF02148
(zf-UBP)
5 GLY A 423
GLY A 151
LEU A 210
ILE A 407
ALA A 155
None
1.04A 4qtuB-4msxA:
undetectable
4qtuB-4msxA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mz1 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Campylobacter
jejuni)
PF00478
(IMPDH)
5 GLY A 357
GLY A 335
ILE A 300
ILE A  44
ALA A  46
IMP  A 500 (-3.5A)
IMP  A 500 (-3.5A)
None
None
IMP  A 500 (-3.3A)
1.11A 4qtuB-4mz1A:
undetectable
4qtuB-4mz1A:
17.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qdk MAGNESIUM-PROTOPORPH
YRIN
O-METHYLTRANSFERASE


(Synechocystis
sp. PCC 6803)
PF07109
(Mg-por_mtran_C)
5 GLY A  70
GLY A  72
ILE A  92
SER A  93
MET A  96
SAH  A 301 (-3.4A)
SAH  A 301 (-3.6A)
SAH  A 301 (-3.6A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.2A)
0.45A 4qtuB-4qdkA:
17.4
4qtuB-4qdkA:
26.72
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.
4qed ELXO

(Staphylococcus
epidermidis)
PF13561
(adh_short_C2)
5 GLY A 184
GLY A 215
ILE A 208
SER A 206
ILE A 242
None
1.10A 4qtuB-4qedA:
5.5
4qtuB-4qedA:
20.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qtu PUTATIVE
METHYLTRANSFERASE
BUD23


(Saccharomyces
cerevisiae)
PF08241
(Methyltransf_11)
12 TYR B  14
GLY B  55
GLY B  57
LEU B  60
ILE B  78
SER B  79
MET B  82
MET B 100
ILE B 117
ALA B 119
TRP B 122
ARG B 136
None
SAM  B 301 (-3.7A)
SAM  B 301 (-3.3A)
SAM  B 301 (-4.0A)
SAM  B 301 (-3.7A)
EDO  B 310 ( 3.0A)
SAM  B 301 (-4.4A)
SAM  B 301 (-4.2A)
SAM  B 301 (-4.2A)
SAM  B 301 (-3.5A)
SAM  B 301 ( 4.1A)
SAM  B 301 ( 4.6A)
0.00A 4qtuB-4qtuB:
39.9
4qtuB-4qtuB:
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.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE


(Plasmodium
falciparum)
PF13649
(Methyltransf_25)
5 TYR A  19
GLY A  63
GLY A  65
ILE A  86
ALA A 129
SAH  A 302 ( 4.1A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.3A)
0.73A 4qtuB-4r6wA:
18.9
4qtuB-4r6wA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s3m 2-DEHYDROPANTOATE
2-REDUCTASE


(Staphylococcus
aureus)
PF02558
(ApbA)
PF08546
(ApbA_C)
5 GLY A  14
GLY A   9
ILE A  38
ILE A  67
ALA A  18
None
NAP  A 500 ( 3.8A)
None
None
None
1.13A 4qtuB-4s3mA:
4.5
4qtuB-4s3mA:
24.15
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.
4tkt AT-LESS POLYKETIDE
SYNTHASE


(Streptomyces
platensis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 GLY A3346
GLY A3270
LEU A3296
SER A3325
ALA A3499
None
1.09A 4qtuB-4tktA:
undetectable
4qtuB-4tktA:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ure CYCLOHEXANOL
DEHYDROGENASE


(Aromatoleum
aromaticum)
PF13561
(adh_short_C2)
6 GLY A  12
GLY A  14
ILE A  37
SER A  38
ILE A  17
ARG A 109
None
1.44A 4qtuB-4ureA:
6.8
4qtuB-4ureA:
22.61
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.
4x0e PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 TYR A 137
GLY A 131
LEU A 156
SER A 133
ALA A 110
None
1.13A 4qtuB-4x0eA:
undetectable
4qtuB-4x0eA:
19.21
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.
4x0e PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 TYR A 137
GLY A 131
SER A 133
ILE A 114
ALA A 110
None
0.99A 4qtuB-4x0eA:
undetectable
4qtuB-4x0eA:
19.21
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.
4ybr NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 TYR A 137
GLY A 131
LEU A 156
SER A 133
ALA A 110
None
None
None
None
NAP  A 301 (-3.6A)
0.96A 4qtuB-4ybrA:
undetectable
4qtuB-4ybrA:
21.15
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.
4ybr NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 TYR A 137
GLY A 131
SER A 133
ILE A 114
ALA A 110
None
None
None
NAP  A 301 (-3.9A)
NAP  A 301 (-3.6A)
0.92A 4qtuB-4ybrA:
undetectable
4qtuB-4ybrA:
21.15
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.
4yco TRNA-DIHYDROURIDINE
SYNTHASE C


(Escherichia
coli)
PF01207
(Dus)
5 GLY A 109
GLY A  71
LEU A  69
SER A 106
ALA A  98
None
None
None
A  D  14 ( 2.7A)
U  D  16 ( 3.3A)
0.94A 4qtuB-4ycoA:
undetectable
4qtuB-4ycoA:
20.31
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.
4zg8 ENDOGLUCANASE

(Perinereis
brevicirris)
PF00759
(Glyco_hydro_9)
5 GLY A 422
GLY A 425
LEU A  16
ILE A 315
ALA A 310
None
1.11A 4qtuB-4zg8A:
undetectable
4qtuB-4zg8A:
18.63
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.
4zlg PUTATIVE B-GLYCAN
PHOSPHORYLASE


(Saccharophagus
degradans)
PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36)
6 GLY A 568
LEU A 488
ILE A 566
SER A 563
ILE A 522
ALA A 570
None
1.38A 4qtuB-4zlgA:
undetectable
4qtuB-4zlgA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zrq TRANSCOBALAMIN-2

(Homo sapiens)
PF01122
(Cobalamin_bind)
PF14478
(DUF4430)
5 GLY A 142
GLY A 140
LEU A 183
SER A 135
ALA A  88
None
None
None
CNC  A 501 ( 4.0A)
None
1.09A 4qtuB-4zrqA:
undetectable
4qtuB-4zrqA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aex AMMONIUM TRANSPORTER
MEP2


(Saccharomyces
cerevisiae)
PF00909
(Ammonium_transp)
5 GLY A 299
GLY A 323
ILE A 296
ILE A 318
ALA A 267
None
1.01A 4qtuB-5aexA:
undetectable
4qtuB-5aexA:
18.52
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.
5cm2 TRNA
METHYLTRANSFERASE


(Yarrowia
lipolytica)
PF08241
(Methyltransf_11)
5 GLY Z  64
GLY Z  66
SER Z  85
ILE Z 122
ARG Z 133
None
0.90A 4qtuB-5cm2Z:
15.1
4qtuB-5cm2Z:
23.89
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.
5evy SALICYLATE
HYDROXYLASE


(Pseudomonas
putida)
PF01494
(FAD_binding_3)
5 GLY X 223
LEU X 219
SER X 243
ALA X 240
ARG X 260
None
1.02A 4qtuB-5evyX:
undetectable
4qtuB-5evyX:
17.69
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.
5jnq PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE


([Clostridium]
bolteae)
PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1)
5 TYR A  73
GLY A 208
ILE A 206
ILE A   6
ALA A   8
None
1.09A 4qtuB-5jnqA:
undetectable
4qtuB-5jnqA:
20.95
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.
5jsc PUTATIVE ACYL-COA
DEHYDROGENASE


(Paraburkholderia
xenovorans)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 GLY A 107
GLY A 105
LEU A 101
ILE A 111
SER A 112
None
1.06A 4qtuB-5jscA:
undetectable
4qtuB-5jscA:
20.90
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.
5jyd SHORT CHAIN
DEHYDROGENASE


(Burkholderia
cenocepacia)
PF13561
(adh_short_C2)
5 TYR A 252
GLY A  82
GLY A  80
ILE A  87
ALA A  85
None
None
NAD  A 901 (-3.0A)
None
None
1.11A 4qtuB-5jydA:
6.7
4qtuB-5jydA:
20.06
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.
5k8d COAGULATION FACTOR
VIII
COAGULATION FACTOR
VIII,IG GAMMA-1
CHAIN C REGION


(Homo sapiens;
Homo sapiens)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
PF00754
(F5_F8_type_C)
PF07731
(Cu-oxidase_2)
5 GLY A 655
GLY A 686
LEU A 631
ILE B1790
ALA B1800
None
0.98A 4qtuB-5k8dA:
undetectable
4qtuB-5k8dA:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k8d COAGULATION FACTOR
VIII
COAGULATION FACTOR
VIII,IG GAMMA-1
CHAIN C REGION


(Homo sapiens;
Homo sapiens)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
PF00754
(F5_F8_type_C)
PF07731
(Cu-oxidase_2)
5 GLY A 686
LEU A 631
ILE B1790
SER B1791
ALA B1800
None
1.11A 4qtuB-5k8dA:
undetectable
4qtuB-5k8dA:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93


(Porphyromonas
gingivalis)
no annotation 5 GLY A 680
GLY A 664
LEU A 666
SER A 683
ALA A 714
None
1.14A 4qtuB-5m11A:
undetectable
4qtuB-5m11A:
15.51
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.
5mqs BETA-L-ARABINOBIOSID
ASE


(Bacteroides
thetaiotaomicron)
PF13088
(BNR_2)
5 GLY A 945
ILE A 810
SER A 809
MET A 806
ILE A 947
None
1.10A 4qtuB-5mqsA:
undetectable
4qtuB-5mqsA:
11.37
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.
5nyj ANBU

(Hyphomicrobium
sp. MC1)
PF00227
(Proteasome)
5 GLY A 119
ILE A 132
ILE A 122
ALA A  86
ARG A  95
None
1.14A 4qtuB-5nyjA:
undetectable
4qtuB-5nyjA:
21.27
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.
5o0s GLUCOSYLCERAMIDASE

(Thermoanaerobacterium
xylanolyticum)
PF04685
(DUF608)
PF12215
(Glyco_hydr_116N)
PF17168
(DUF5127)
5 GLY A 365
ILE A 371
SER A 368
ILE A 344
TRP A 340
None
None
EDO  A 902 (-3.6A)
None
None
1.13A 4qtuB-5o0sA:
undetectable
4qtuB-5o0sA:
13.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tj3 ALKALINE PHOSPHATASE
PAFA


(Elizabethkingia
meningoseptica)
PF01663
(Phosphodiest)
5 GLY A  89
LEU A 168
SER A 533
ILE A  86
ALA A 520
None
1.03A 4qtuB-5tj3A:
undetectable
4qtuB-5tj3A:
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.
5wmm NRPS

(Micromonospora
sp. ML1)
no annotation 5 TYR A 484
GLY A 542
GLY A 544
LEU A 547
SER A 565
SAH  A1002 ( 3.8A)
SAH  A1002 (-3.7A)
SAH  A1002 (-3.4A)
SAH  A1002 (-3.7A)
SAH  A1002 ( 4.9A)
0.83A 4qtuB-5wmmA:
14.4
4qtuB-5wmmA:
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.
5xhu FERREDOXIN--NADP
REDUCTASE


(Bacillus
subtilis)
no annotation 5 GLY A  14
GLY A  15
LEU A  86
ILE A  18
ILE A  36
FAD  A1000 (-3.3A)
None
None
FAD  A1000 (-3.9A)
None
1.10A 4qtuB-5xhuA:
3.0
4qtuB-5xhuA:
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.
5y2a INSECT GROUP II
CHITINASE


(Ostrinia
furnacalis)
no annotation 5 GLY A2299
ILE A2245
SER A2246
MET A2396
ALA A2224
None
1.11A 4qtuB-5y2aA:
undetectable
4qtuB-5y2aA:
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.
6d47 BETA SLIDING CLAMP

(Mycobacterium
marinum)
no annotation 5 GLY A  83
GLY A  44
LEU A  46
ILE A  56
ALA A  30
None
0.99A 4qtuB-6d47A:
undetectable
4qtuB-6d47A:
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.
6f5z 24-STEROL
C-METHYLTRANSFERASE


(Haloferax
volcanii)
no annotation 5 GLY A  46
GLY A  48
SER A  71
MET A  74
ALA A 112
SAH  A 301 (-3.5A)
SAH  A 301 ( 3.7A)
None
SAH  A 301 (-4.0A)
SAH  A 301 (-3.5A)
0.70A 4qtuB-6f5zA:
20.1
4qtuB-6f5zA:
undetectable