SIMILAR PATTERNS OF AMINO ACIDS FOR 1N4H_A_REAA500_1

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.
1dle COMPLEMENT FACTOR B

(Homo sapiens)
PF00089
(Trypsin)
5 GLN A  30
ILE A  33
ALA A  31
VAL A  52
VAL A 212
None
0.97A 1n4hA-1dleA:
0.0
1n4hA-1dleA:
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.
1dle COMPLEMENT FACTOR B

(Homo sapiens)
PF00089
(Trypsin)
5 GLN A  30
ILE A  33
ALA A  31
VAL A 212
ALA A 104
None
1.02A 1n4hA-1dleA:
0.0
1n4hA-1dleA:
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.
1erz N-CARBAMYL-D-AMINO
ACID AMIDOHYDROLASE


(Agrobacterium
sp. KNK712)
PF00795
(CN_hydrolase)
5 ILE A 190
ALA A 228
MET A 183
ARG A 181
LEU A 113
None
1.11A 1n4hA-1erzA:
0.0
1n4hA-1erzA:
21.88
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.
1gud D-ALLOSE-BINDING
PERIPLASMIC PROTEIN


(Escherichia
coli)
PF13407
(Peripla_BP_4)
5 CYH A 199
ALA A 169
VAL A 187
ARG A 190
ALA A 211
None
1.20A 1n4hA-1gudA:
0.0
1n4hA-1gudA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1itz TRANSKETOLASE

(Zea mays)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
5 GLN A 131
CYH A 430
ILE A 429
ALA A 134
ALA A 391
None
1.22A 1n4hA-1itzA:
0.0
1n4hA-1itzA:
16.89
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.
1j2q PROTEASOME ALPHA
SUBUNIT
PROTEASOME BETA
SUBUNIT


(Archaeoglobus
fulgidus)
PF00227
(Proteasome)
PF10584
(Proteasome_A_N)
5 GLN A  97
ILE A  74
ALA A  96
ARG H  69
LEU A  48
None
1.14A 1n4hA-1j2qA:
undetectable
1n4hA-1j2qA:
22.43
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.
1n3s GTP CYCLOHYDROLASE I

(Escherichia
coli)
PF01227
(GTP_cyclohydroI)
5 ALA A 121
VAL A 141
VAL A 171
LEU A  14
ALA A 161
None
1.24A 1n4hA-1n3sA:
0.0
1n4hA-1n3sA:
21.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1nq7 NUCLEAR RECEPTOR
ROR-BETA


(Rattus
norvegicus)
PF00104
(Hormone_recep)
11 GLN A 228
CYH A 262
ILE A 266
ALA A 269
VAL A 303
ARG A 306
MET A 307
ARG A 309
VAL A 318
LEU A 338
ALA A 342
ARL  A 800 (-4.7A)
ARL  A 800 (-3.5A)
None
ARL  A 800 ( 3.9A)
ARL  A 800 ( 4.7A)
ARL  A 800 (-4.4A)
ARL  A 800 (-3.7A)
ARL  A 800 ( 4.9A)
None
ARL  A 800 ( 4.8A)
ARL  A 800 ( 4.1A)
0.23A 1n4hA-1nq7A:
41.5
1n4hA-1nq7A:
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2


(Synechocystis
sp. PCC 6803)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
5 ILE A 362
VAL A 392
VAL A 202
LEU A 384
ALA A 342
None
1.21A 1n4hA-1ofeA:
0.0
1n4hA-1ofeA:
10.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qon ACETYLCHOLINESTERASE

(Drosophila
melanogaster)
PF00135
(COesterase)
5 ILE A  32
ALA A  59
VAL A  14
ARG A  15
ALA A 224
None
1.04A 1n4hA-1qonA:
undetectable
1n4hA-1qonA:
19.92
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.
1rrv GLYCOSYLTRANSFERASE
GTFD


(Amycolatopsis
orientalis)
PF03033
(Glyco_transf_28)
5 ALA A  21
VAL A  48
MET A  33
VAL A   7
ALA A  39
ALA  A  21 ( 0.0A)
VAL  A  48 ( 0.6A)
MET  A  33 ( 0.0A)
VAL  A   7 ( 0.6A)
ALA  A  39 ( 0.0A)
1.09A 1n4hA-1rrvA:
undetectable
1n4hA-1rrvA:
19.05
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.
1rtk COMPLEMENT FACTOR B

(Homo sapiens)
PF00089
(Trypsin)
PF00092
(VWA)
5 GLN A 471
ILE A 474
ALA A 472
VAL A 496
VAL A 691
None
0.99A 1n4hA-1rtkA:
undetectable
1n4hA-1rtkA:
17.87
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.
1rtk COMPLEMENT FACTOR B

(Homo sapiens)
PF00089
(Trypsin)
PF00092
(VWA)
5 GLN A 471
ILE A 474
ALA A 472
VAL A 691
ALA A 553
None
1.05A 1n4hA-1rtkA:
undetectable
1n4hA-1rtkA:
17.87
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.
1vc9 NDX1

(Thermus
thermophilus)
PF00293
(NUDIX)
5 ALA A 120
VAL A   8
MET A  81
ARG A  82
ALA A  43
None
1.19A 1n4hA-1vc9A:
undetectable
1n4hA-1vc9A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zo1 TRANSLATION
INITIATION FACTOR 2


(Escherichia
coli)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2)
5 ILE I 384
ALA I 383
VAL I 330
VAL I 369
LEU I 244
None
1.24A 1n4hA-1zo1I:
undetectable
1n4hA-1zo1I:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a4k 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE


(Thermus
thermophilus)
PF13561
(adh_short_C2)
5 ALA A  74
VAL A  34
VAL A 118
LEU A 221
ALA A  85
None
1.17A 1n4hA-2a4kA:
undetectable
1n4hA-2a4kA:
23.34
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.
2aif RIBOSOMAL PROTEIN
L7A


(Cryptosporidium
parvum)
PF01248
(Ribosomal_L7Ae)
5 ILE A  27
ALA A  19
VAL A  86
LEU A  40
ALA A 107
None
1.04A 1n4hA-2aifA:
undetectable
1n4hA-2aifA:
18.15
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT


(Stenotrophomonas
maltophilia)
PF01571
(GCV_T)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4)
5 ALA A 161
ARG A 278
ARG A  16
LEU A  25
ALA A  34
None
1.25A 1n4hA-2gahA:
undetectable
1n4hA-2gahA:
13.30
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.
2guu ODCASE

(Plasmodium
vivax)
PF00215
(OMPdecase)
5 CYH A  37
ILE A  38
ALA A 337
VAL A  32
LEU A 157
None
1.23A 1n4hA-2guuA:
undetectable
1n4hA-2guuA:
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.
2gx8 NIF3-RELATED PROTEIN

(Bacillus cereus)
PF01784
(NIF3)
5 ILE A 208
ALA A 161
VAL A 216
MET A 220
VAL A 142
None
1.26A 1n4hA-2gx8A:
undetectable
1n4hA-2gx8A:
20.69
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.
2i9u CYTOSINE/GUANINE
DEAMINASE RELATED
PROTEIN


(Clostridium
acetobutylicum)
PF01979
(Amidohydro_1)
5 ILE A 153
ALA A 155
VAL A 130
VAL A 374
LEU A 386
None
1.11A 1n4hA-2i9uA:
undetectable
1n4hA-2i9uA:
21.78
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.
2ijz PROBABLE M18-FAMILY
AMINOPEPTIDASE 2


(Pseudomonas
aeruginosa)
PF02127
(Peptidase_M18)
5 ALA A 421
ARG A  77
VAL A 391
LEU A 395
ALA A 306
None
1.21A 1n4hA-2ijzA:
undetectable
1n4hA-2ijzA:
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.
2iss GLUTAMINE
AMIDOTRANSFERASE
SUBUNIT PDXT


(Thermotoga
maritima)
PF01174
(SNO)
5 CYH D  78
ILE D  82
ALA D  85
ARG D  87
ALA D 107
None
1.22A 1n4hA-2issD:
undetectable
1n4hA-2issD:
21.29
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.
2j4r EXOPOLYPHOSPHATASE

(Aquifex
aeolicus)
PF02541
(Ppx-GppA)
5 ILE A  16
ALA A  84
VAL A 111
LEU A  55
ALA A  96
None
1.22A 1n4hA-2j4rA:
undetectable
1n4hA-2j4rA:
23.12
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.
2lao LYSINE, ARGININE,
ORNITHINE-BINDING
PROTEIN


(Salmonella
enterica)
PF00497
(SBP_bac_3)
5 ILE A  68
ALA A  66
VAL A  43
LEU A 217
ALA A 213
None
1.06A 1n4hA-2laoA:
undetectable
1n4hA-2laoA:
21.00
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.
2pan GLYOXYLATE
CARBOLIGASE


(Escherichia
coli)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 GLN A 537
ILE A 531
ALA A 534
VAL A 551
LEU A 555
None
1.23A 1n4hA-2panA:
undetectable
1n4hA-2panA:
17.84
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.
2ppg PUTATIVE ISOMERASE

(Sinorhizobium
meliloti)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ILE A 323
ALA A 326
VAL A 376
LEU A 386
ALA A 382
None
1.05A 1n4hA-2ppgA:
undetectable
1n4hA-2ppgA:
20.15
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
5 ILE A 244
ALA A 247
VAL A 254
LEU A 310
ALA A 257
None
1.11A 1n4hA-2pt6A:
undetectable
1n4hA-2pt6A:
22.55
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG


(Mycobacterium
tuberculosis)
PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred)
5 ILE A 681
VAL A 668
ARG A 666
VAL A 623
ALA A 639
None
1.19A 1n4hA-2pziA:
undetectable
1n4hA-2pziA:
17.04
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.
2rfb CYTOCHROME P450

(Picrophilus
torridus)
PF00067
(p450)
5 ARG A 211
MET A 209
VAL A 231
LEU A 111
ALA A 317
None
1.27A 1n4hA-2rfbA:
undetectable
1n4hA-2rfbA:
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.
2vmf BETA-MANNOSIDASE

(Bacteroides
thetaiotaomicron)
PF00703
(Glyco_hydro_2)
5 ILE A 414
VAL A 416
ARG A 507
VAL A 350
ALA A 357
None
None
EDO  A1869 ( 3.7A)
None
None
1.21A 1n4hA-2vmfA:
undetectable
1n4hA-2vmfA:
15.87
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.
2xwb COMPLEMENT FACTOR B

(Homo sapiens)
PF00084
(Sushi)
PF00089
(Trypsin)
PF00092
(VWA)
5 GLN F 471
ILE F 474
ALA F 472
VAL F 691
ALA F 553
None
1.00A 1n4hA-2xwbF:
undetectable
1n4hA-2xwbF:
14.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ycd GLUTATHIONE
S-TRANSFERASE


(Agrobacterium
tumefaciens)
PF02798
(GST_N)
PF13410
(GST_C_2)
5 GLN A  78
ILE A  89
VAL A  45
LEU A 180
ALA A 176
None
1.18A 1n4hA-2ycdA:
undetectable
1n4hA-2ycdA:
21.56
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.
2yv3 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Thermus
thermophilus)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
5 ILE A  16
ALA A 320
VAL A  19
ARG A  23
LEU A  43
None
1.22A 1n4hA-2yv3A:
undetectable
1n4hA-2yv3A:
21.01
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.
2z0q RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 3


(Mus musculus)
PF00621
(RhoGEF)
5 GLN A 245
ILE A 334
ALA A 337
VAL A 271
LEU A 319
None
1.28A 1n4hA-2z0qA:
undetectable
1n4hA-2z0qA:
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.
2zvf ALANYL-TRNA
SYNTHETASE


(Archaeoglobus
fulgidus)
PF02272
(DHHA1)
5 GLN A 886
ILE A 865
ALA A 869
VAL A 884
VAL A 814
None
1.25A 1n4hA-2zvfA:
undetectable
1n4hA-2zvfA:
21.32
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.
3bvc UNCHARACTERIZED
PROTEIN ISM_01780


(Roseovarius
nubinhibens)
PF13759
(2OG-FeII_Oxy_5)
5 ILE A  38
ALA A  37
MET A  31
VAL A 132
LEU A 105
None
1.07A 1n4hA-3bvcA:
undetectable
1n4hA-3bvcA:
18.70
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.
3dwf 11-BETA-HYDROXYSTERO
ID DEHYDROGENASE 1


(Cavia porcellus)
PF00106
(adh_short)
5 ILE A  50
ALA A  42
VAL A  39
LEU A  32
ALA A  59
None
1.21A 1n4hA-3dwfA:
undetectable
1n4hA-3dwfA:
22.04
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.
3e4v NADH:FMN
OXIDOREDUCTASE LIKE
PROTEIN


(Methylobacillus
flagellatus)
PF01613
(Flavin_Reduct)
5 ILE A 144
ALA A  10
VAL A 141
VAL A  20
LEU A 113
None
1.20A 1n4hA-3e4vA:
undetectable
1n4hA-3e4vA:
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.
3fmx TARTRATE
DEHYDROGENASE/DECARB
OXYLASE


(Pseudomonas
putida)
PF00180
(Iso_dh)
5 ILE X 263
ALA X 266
ARG X 111
VAL X 116
ALA X 119
NAI  X 401 (-4.5A)
None
None
None
None
1.13A 1n4hA-3fmxX:
undetectable
1n4hA-3fmxX:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g8d BIOTIN CARBOXYLASE

(Escherichia
coli)
PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
5 ILE A  66
ALA A  69
VAL A   6
VAL A  42
ALA A  14
None
1.21A 1n4hA-3g8dA:
undetectable
1n4hA-3g8dA:
21.90
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.
3gb0 PEPTIDASE T

(Bacillus cereus)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ILE A 211
ALA A 210
MET A 264
VAL A 182
ALA A 225
None
1.17A 1n4hA-3gb0A:
undetectable
1n4hA-3gb0A:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB


(Bacteroides
thetaiotaomicron)
PF00092
(VWA)
5 ILE A 199
ALA A 195
VAL A 187
ARG A 188
ALA A 179
None
1.13A 1n4hA-3ibsA:
undetectable
1n4hA-3ibsA:
21.69
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.
3ixw HEMOCYANIN AA6 CHAIN

(Androctonus
australis)
PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C)
5 VAL A  94
ARG A  99
VAL A  61
LEU A  53
ALA A  56
None
1.28A 1n4hA-3ixwA:
undetectable
1n4hA-3ixwA:
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.
3kb3 PROTEIN PHOSPHATASE
2C 16


(Arabidopsis
thaliana)
PF00481
(PP2C)
5 GLN B 475
ILE B 496
ALA B 478
VAL B 498
VAL B 208
None
1.26A 1n4hA-3kb3B:
undetectable
1n4hA-3kb3B:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kn1 GOLGI PHOSPHOPROTEIN
3


(Homo sapiens)
PF05719
(GPP34)
5 CYH A  92
ILE A  95
ALA A  98
VAL A 288
ALA A 295
None
1.15A 1n4hA-3kn1A:
undetectable
1n4hA-3kn1A:
24.75
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.
3l4i HEAT SHOCK 70
(HSP70) PROTEIN


(Cryptosporidium
parvum)
PF00012
(HSP70)
5 GLN A 141
ILE A 180
ALA A 181
VAL A  57
ALA A  85
None
1.19A 1n4hA-3l4iA:
undetectable
1n4hA-3l4iA:
21.47
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.
3ls2 S-FORMYLGLUTATHIONE
HYDROLASE


(Pseudoalteromonas
haloplanktis)
PF00756
(Esterase)
5 GLN A  17
ALA A  32
VAL A  10
LEU A 271
ALA A  71
None
1.23A 1n4hA-3ls2A:
undetectable
1n4hA-3ls2A:
20.56
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.
3lwg HP0420 HOMOLOGUE

(Helicobacter
felis)
no annotation 5 ILE A  86
ALA A  84
VAL A 119
VAL A  80
ALA A  60
None
1.12A 1n4hA-3lwgA:
undetectable
1n4hA-3lwgA:
22.09
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.
3nrb FORMYLTETRAHYDROFOLA
TE DEFORMYLASE


(Pseudomonas
putida)
PF00551
(Formyl_trans_N)
PF01842
(ACT)
5 ALA A 165
ARG A 188
VAL A 266
LEU A 101
ALA A 171
None
1.08A 1n4hA-3nrbA:
undetectable
1n4hA-3nrbA:
21.14
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.
3o04 BETA-KETO-ACYL
CARRIER PROTEIN
SYNTHASE II


(Listeria
monocytogenes)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
5 ILE A 105
ALA A  82
VAL A 147
ARG A 150
VAL A 101
None
1.26A 1n4hA-3o04A:
undetectable
1n4hA-3o04A:
19.05
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.
3oit OS07G0271500 PROTEIN

(Oryza sativa)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
5 ILE A 248
ALA A  27
VAL A 234
ARG A 195
ALA A 180
None
1.25A 1n4hA-3oitA:
undetectable
1n4hA-3oitA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qgv ALPHA AMYLASE

(Pyrococcus
woesei)
PF00128
(Alpha-amylase)
PF09154
(DUF1939)
5 ILE A  93
ALA A  96
VAL A 103
LEU A  70
ALA A  50
None
1.10A 1n4hA-3qgvA:
undetectable
1n4hA-3qgvA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s8m ENOYL-ACP REDUCTASE

(Xanthomonas
oryzae)
PF07055
(Eno-Rase_FAD_bd)
PF12241
(Enoyl_reductase)
PF12242
(Eno-Rase_NADH_b)
5 GLN A 179
ILE A 231
ALA A 167
VAL A 284
VAL A 355
None
1.16A 1n4hA-3s8mA:
undetectable
1n4hA-3s8mA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3slk POLYKETIDE SYNTHASE
EXTENDER MODULE 2


(Saccharopolyspora
spinosa)
PF08240
(ADH_N)
PF08659
(KR)
PF13602
(ADH_zinc_N_2)
5 ILE A 342
ALA A 340
VAL A 495
LEU A 371
ALA A 356
None
None
None
None
NDP  A 801 (-3.1A)
1.12A 1n4hA-3slkA:
undetectable
1n4hA-3slkA:
14.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tzw POLYKETIDE SYNTHASE
PKS13


(Mycobacterium
tuberculosis)
PF00698
(Acyl_transf_1)
5 ILE A1057
ALA A1055
VAL A 625
LEU A 689
ALA A 685
None
1.25A 1n4hA-3tzwA:
undetectable
1n4hA-3tzwA:
19.31
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.
3wj7 PUTATIVE
OXIDOREDUCTASE


(Gluconobacter
oxydans)
PF01370
(Epimerase)
5 ILE A 196
ALA A 328
VAL A 182
ARG A 319
LEU A 246
None
1.13A 1n4hA-3wj7A:
undetectable
1n4hA-3wj7A:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wuy NITRILASE

(Synechocystis
sp. PCC 6803)
PF00795
(CN_hydrolase)
5 ILE A  38
ALA A  97
VAL A 104
LEU A 272
ALA A  16
None
1.07A 1n4hA-3wuyA:
undetectable
1n4hA-3wuyA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyv AOX3

(Mus musculus)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C)
5 ILE A1307
ALA A1310
VAL A1283
ARG A1287
ALA A1278
None
1.20A 1n4hA-3zyvA:
undetectable
1n4hA-3zyvA:
12.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4auk RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE M


(Escherichia
coli)
PF01728
(FtsJ)
5 ILE A 336
ALA A 334
ARG A 354
LEU A 305
ALA A 286
None
None
TLA  A1363 (-2.8A)
None
None
1.25A 1n4hA-4aukA:
undetectable
1n4hA-4aukA:
21.72
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.
4bmh ACETYLTRANSFERASE

(Streptomyces
sviceus)
PF00583
(Acetyltransf_1)
6 CYH A  75
ILE A  74
ALA A 121
VAL A 113
ARG A  64
VAL A 104
None
1.50A 1n4hA-4bmhA:
undetectable
1n4hA-4bmhA:
19.66
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.
4dal PUTATIVE ALDEHYDE
DEHYDROGENASE


(Sinorhizobium
meliloti)
PF00171
(Aldedh)
5 ILE A 268
ALA A 283
VAL A 253
LEU A 261
ALA A 259
None
0.88A 1n4hA-4dalA:
undetectable
1n4hA-4dalA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4du6 GTP CYCLOHYDROLASE 1

(Yersinia pestis)
PF01227
(GTP_cyclohydroI)
5 ALA A 120
VAL A 140
VAL A 170
LEU A  15
ALA A 160
None
1.25A 1n4hA-4du6A:
undetectable
1n4hA-4du6A:
22.26
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.
4ezb UNCHARACTERIZED
CONSERVED PROTEIN


(Sinorhizobium
meliloti)
PF03807
(F420_oxidored)
PF09130
(DUF1932)
5 ILE A  62
ALA A   5
VAL A  68
VAL A  72
ALA A  81
None
1.21A 1n4hA-4ezbA:
undetectable
1n4hA-4ezbA:
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.
4igm 2-AMINO-3-CARBOXYMUC
ONATE-6-SEMIALDEHYDE
DECARBOXYLASE


(Homo sapiens)
PF04909
(Amidohydro_2)
5 ILE A 143
MET A 129
ARG A 131
LEU A 218
ALA A 164
None
1.24A 1n4hA-4igmA:
undetectable
1n4hA-4igmA:
20.29
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.
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE


(Salmonella
enterica)
PF02277
(DBI_PRT)
5 ALA A 254
VAL A 281
VAL A 172
LEU A 235
ALA A 270
None
1.06A 1n4hA-4kqkA:
undetectable
1n4hA-4kqkA:
20.61
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.
4l3w LIPASE

(Rhizopus
microsporus)
PF01764
(Lipase_3)
5 ILE A  94
ARG A 108
VAL A 146
LEU A 185
ALA A 181
None
0.99A 1n4hA-4l3wA:
undetectable
1n4hA-4l3wA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n6b SERINE
ACETYLTRANSFERASE
APOENZYME


(Glycine max)
PF00132
(Hexapep)
PF06426
(SATase_N)
5 ALA A  81
VAL A 127
ARG A 133
LEU A  69
ALA A 142
None
1.13A 1n4hA-4n6bA:
undetectable
1n4hA-4n6bA:
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.
4okq HUT OPERON POSITIVE
REGULATORY PROTEIN


(Geobacillus
thermodenitrificans)
PF09021
(HutP)
5 ILE A  80
ALA A  79
VAL A 124
VAL A  65
ALA A  58
None
1.02A 1n4hA-4okqA:
undetectable
1n4hA-4okqA:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4omu SHIKIMATE
DEHYDROGENASE


(Pseudomonas
putida)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N)
5 ILE A 184
VAL A 181
ARG A 121
VAL A 115
ALA A 233
None
0.98A 1n4hA-4omuA:
undetectable
1n4hA-4omuA:
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.
4qaw XYN30D

(Paenibacillus
barcinonensis)
PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C)
5 ILE A   6
ALA A   4
VAL A 369
LEU A 390
ALA A 388
None
1.23A 1n4hA-4qawA:
undetectable
1n4hA-4qawA:
17.01
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.
4rzm EPOXIDE HYDROLASE
LASB


(Streptomyces
lasaliensis)
PF12680
(SnoaL_2)
5 ALA A  83
ARG A 101
ARG A  99
VAL A  63
LEU A  36
FMT  A 303 ( 4.3A)
None
None
None
None
1.12A 1n4hA-4rzmA:
undetectable
1n4hA-4rzmA:
18.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4s15 NUCLEAR RECEPTOR
ROR-ALPHA


(Homo sapiens)
PF00104
(Hormone_recep)
8 CYH A 323
ILE A 327
ALA A 330
VAL A 364
ARG A 367
MET A 368
ARG A 370
VAL A 379
4D8  A 601 ( 4.0A)
None
4D8  A 601 (-3.1A)
None
GOL  A 602 (-4.5A)
4D8  A 601 (-4.0A)
GOL  A 602 (-3.3A)
None
0.33A 1n4hA-4s15A:
36.7
1n4hA-4s15A:
59.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4s15 NUCLEAR RECEPTOR
ROR-ALPHA


(Homo sapiens)
PF00104
(Hormone_recep)
8 GLN A 289
CYH A 323
ILE A 327
ALA A 330
VAL A 364
MET A 368
ARG A 370
VAL A 379
4D8  A 601 ( 2.7A)
4D8  A 601 ( 4.0A)
None
4D8  A 601 (-3.1A)
None
4D8  A 601 (-4.0A)
GOL  A 602 (-3.3A)
None
0.74A 1n4hA-4s15A:
36.7
1n4hA-4s15A:
59.62
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.
4tu3 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 74


(Saccharomyces
cerevisiae)
PF05719
(GPP34)
5 ILE A 160
VAL A 337
ARG A 340
MET A 341
ALA A 262
None
1.16A 1n4hA-4tu3A:
undetectable
1n4hA-4tu3A:
23.12
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
5 ILE A 244
ALA A 247
VAL A 254
LEU A 310
ALA A 257
None
1.11A 1n4hA-4uoeA:
undetectable
1n4hA-4uoeA:
24.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uzu ALPHA-AMYLASE

(Geobacillus
stearothermophilus)
PF00128
(Alpha-amylase)
PF09154
(DUF1939)
5 ILE A  88
ALA A  91
VAL A  98
LEU A  65
ALA A  46
None
1.23A 1n4hA-4uzuA:
undetectable
1n4hA-4uzuA:
18.76
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.
4wrr PUTATIVE
DIACYLGLYCEROL
KINASE


(Bacillus
anthracis)
PF00781
(DAGK_cat)
5 ILE A 118
ALA A 114
VAL A 107
ARG A 103
VAL A  74
None
1.25A 1n4hA-4wrrA:
undetectable
1n4hA-4wrrA:
23.26
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.
4xfk PUTATIVE BRANCHED
CHAIN AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN


(Brucella ovis)
PF13458
(Peripla_BP_6)
5 ILE A 280
ALA A 283
VAL A 285
ARG A 230
ALA A 314
None
1.11A 1n4hA-4xfkA:
undetectable
1n4hA-4xfkA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xfk PUTATIVE BRANCHED
CHAIN AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN


(Brucella ovis)
PF13458
(Peripla_BP_6)
5 ILE A 280
VAL A 285
ARG A 230
VAL A 248
ALA A 314
None
1.08A 1n4hA-4xfkA:
undetectable
1n4hA-4xfkA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y1p 3-ISOPROPYLMALATE
DEHYDROGENASE


(Sulfolobus
acidocaldarius)
PF00180
(Iso_dh)
5 ILE A 332
ALA A 331
VAL A 308
VAL A 319
LEU A 276
None
1.22A 1n4hA-4y1pA:
undetectable
1n4hA-4y1pA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zck GTP-BINDING PROTEIN
TYPA/BIPA


(Escherichia
coli)
PF00679
(EFG_C)
5 ILE A 449
VAL A 307
MET A 309
ARG A 357
VAL A 382
None
1.11A 1n4hA-4zckA:
undetectable
1n4hA-4zckA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zdk CTP SYNTHASE

(Mycobacterium
tuberculosis)
PF00117
(GATase)
PF06418
(CTP_synth_N)
5 ILE A 401
ALA A 404
VAL A 425
VAL A 508
LEU A 394
None
None
None
None
ONL  A 601 ( 4.1A)
1.07A 1n4hA-4zdkA:
undetectable
1n4hA-4zdkA:
18.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a5g FORMATE--TETRAHYDROF
OLATE LIGASE


(Tepidanaerobacter
acetatoxydans)
PF01268
(FTHFS)
5 ALA A 115
VAL A 410
VAL A 297
LEU A  86
ALA A 422
None
1.17A 1n4hA-5a5gA:
undetectable
1n4hA-5a5gA:
19.04
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.
5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT


(Candidatus
Kuenenia
stuttgartiensis)
no annotation 5 CYH A 583
ILE A 459
ALA A 603
VAL A 489
LEU A 575
HEC  A 905 (-1.8A)
None
None
None
None
1.19A 1n4hA-5c2vA:
undetectable
1n4hA-5c2vA:
16.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA


(Homo sapiens)
PF00104
(Hormone_recep)
7 CYH A 320
ALA A 327
VAL A 361
ARG A 364
ARG A 367
VAL A 376
LEU A 396
GOL  A 607 ( 4.0A)
None
None
None
None
None
None
0.74A 1n4hA-5c4tA:
29.8
1n4hA-5c4tA:
49.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA


(Homo sapiens)
PF00104
(Hormone_recep)
7 CYH A 320
ALA A 327
VAL A 361
ARG A 364
MET A 365
ARG A 367
LEU A 396
GOL  A 607 ( 4.0A)
None
None
None
None
None
None
0.79A 1n4hA-5c4tA:
29.8
1n4hA-5c4tA:
49.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA


(Homo sapiens)
PF00104
(Hormone_recep)
7 GLN A 286
CYH A 320
ALA A 327
VAL A 361
ARG A 367
VAL A 376
LEU A 396
None
GOL  A 607 ( 4.0A)
None
None
None
None
None
1.05A 1n4hA-5c4tA:
29.8
1n4hA-5c4tA:
49.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA


(Homo sapiens)
PF00104
(Hormone_recep)
7 GLN A 286
CYH A 320
ALA A 327
VAL A 361
MET A 365
ARG A 367
LEU A 396
None
GOL  A 607 ( 4.0A)
None
None
None
None
None
1.06A 1n4hA-5c4tA:
29.8
1n4hA-5c4tA:
49.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cwo DESIGNED HELICAL
REPEAT PROTEIN


(synthetic
construct)
no annotation 5 GLN A 110
ILE A 104
ALA A 107
VAL A 116
ALA A 123
None
1.14A 1n4hA-5cwoA:
undetectable
1n4hA-5cwoA:
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.
5h80 CARBOXYLASE

(Deinococcus
radiodurans)
PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
5 ILE A 254
ALA A 257
VAL A 210
VAL A 276
ALA A 242
None
0.79A 1n4hA-5h80A:
undetectable
1n4hA-5h80A:
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.
5k0y RIBOSOMAL PROTEIN
ES17


(Oryctolagus
cuniculus)
no annotation 5 ILE e  16
ALA e  13
VAL e  54
MET e  58
ARG e  60
None
None
None
None
C  A1460 ( 3.6A)
1.11A 1n4hA-5k0ye:
undetectable
1n4hA-5k0ye:
18.25
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.
5k9x TRYPTOPHAN SYNTHASE
ALPHA CHAIN


(Legionella
pneumophila)
PF00290
(Trp_syntA)
5 ILE A  52
ALA A  25
VAL A  81
VAL A  97
ALA A 118
None
1.20A 1n4hA-5k9xA:
undetectable
1n4hA-5k9xA:
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.
5mru TETRACYCLINE
REPRESSOR, CLASS A


(Pseudomonas sp.)
no annotation 5 ILE A  99
ARG A  94
VAL A 145
LEU A  60
ALA A  89
None
None
None
TDC  A 301 ( 4.9A)
None
1.18A 1n4hA-5mruA:
undetectable
1n4hA-5mruA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5opj RHAMNOGALACTURONAN
LYASE


(Bacteroides
thetaiotaomicron)
no annotation 5 CYH A 782
ILE A 724
VAL A 680
VAL A 800
LEU A 773
None
1.26A 1n4hA-5opjA:
undetectable
1n4hA-5opjA:
15.73
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.
5tch TRYPTOPHAN SYNTHASE
BETA CHAIN


(Mycobacterium
tuberculosis)
PF00291
(PALP)
5 GLN B 229
ILE B 254
ALA B 226
VAL B 386
ALA B 368
None
1.28A 1n4hA-5tchB:
undetectable
1n4hA-5tchB:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tp4 AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY


(Burkholderia
ambifaria)
PF01546
(Peptidase_M20)
5 ALA A  47
VAL A  57
MET A  55
VAL A 107
LEU A  80
None
1.09A 1n4hA-5tp4A:
undetectable
1n4hA-5tp4A:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y1i CYTOCHROME P450

(Streptomyces
graminofaciens)
PF00067
(p450)
5 GLN A 402
ILE A 296
ALA A 404
VAL A 151
LEU A 373
None
1.21A 1n4hA-5y1iA:
undetectable
1n4hA-5y1iA:
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.
5y33 ALGINATE LYASE

(Flavobacterium
sp. UMI-01)
no annotation 5 ILE A 104
ALA A 249
VAL A 118
LEU A 198
ALA A 121
None
1.04A 1n4hA-5y33A:
undetectable
1n4hA-5y33A:
14.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ayv FRUCTOSE-1,6-BISPHOS
PHATASE CLASS 2


(Mycobacterium
tuberculosis)
no annotation 5 ILE A 134
VAL A 154
MET A 152
ARG A 175
LEU A 128
GOL  A 404 ( 4.4A)
None
None
None
None
1.22A 1n4hA-6ayvA:
undetectable
1n4hA-6ayvA:
12.60