SIMILAR PATTERNS OF AMINO ACIDS FOR 4R29_D_SAMD301

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.
1akp APOKEDARCIDIN

(actinomycete
ATCC 53650) 		PF00960
(Neocarzinostat) 		5 SER A  29
GLY A 101
ILE A  97
ALA A 109
GLY A 107
 None
 1.10A 4r29D-1akpA:
0.0		 4r29D-1akpA:
19.03
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.
1aog TRYPANOTHIONE
REDUCTASE

(Trypanosoma
cruzi) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A 390
GLY A 422
ILE A 441
GLY A 426
GLU A 379
 None
 1.03A 4r29D-1aogA:
0.0		 4r29D-1aogA:
18.09
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.
1ex0 COAGULATION FACTOR
XIII A CHAIN

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		5 ALA A 192
ARG A  78
GLY A 253
GLY A 329
PHE A 184
 None
 1.11A 4r29D-1ex0A:
0.0		 4r29D-1ex0A:
15.24
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.
1g0v PROTEINASE A

(Saccharomyces
cerevisiae) 		PF00026
(Asp) 		5 GLY A 196
ILE A 214
ALA A 213
GLY A 210
PHE A 194
 None
 1.10A 4r29D-1g0vA:
0.0		 4r29D-1g0vA:
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.
1ivh ISOVALERYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ALA A 268
ILE A 332
ALA A 259
GLY A 261
GLU A  85
 None
 1.12A 4r29D-1ivhA:
2.7		 4r29D-1ivhA:
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.
1iyx ENOLASE

(Enterococcus
hirae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLY A 217
ILE A 286
MET A 240
PHE A 164
GLU A 204
 None
 1.04A 4r29D-1iyxA:
0.0		 4r29D-1iyxA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 GLY A 349
ILE A 210
MET A 209
GLY A 106
PHE A 107
 HEM  A 430 ( 3.9A)
None
None
None
None
 1.04A 4r29D-1lgfA:
0.0		 4r29D-1lgfA:
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.
1ofu CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A  71
GLY A  20
ILE A 151
MET A 105
GLY A 106
 GDP  A1318 ( 4.8A)
GDP  A1318 (-3.5A)
None
None
GDP  A1318 ( 4.3A)
 1.00A 4r29D-1ofuA:
0.0		 4r29D-1ofuA:
20.43
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.
1qmo MANNOSE BINDING
LECTIN, FRIL
MANNOSE BINDING
LECTIN, FRIL

(Lablab
purpureus;
Lablab
purpureus) 		PF00139
(Lectin_legB)
PF00139
(Lectin_legB) 		5 SER E 164
GLY E 156
ILE A  84
ALA A  85
GLY A  87
 MN  A 301 ( 3.7A)
None
None
MAN  A 302 ( 3.7A)
None
 1.07A 4r29D-1qmoE:
undetectable		 4r29D-1qmoE:
21.17
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.
1t5j HYPOTHETICAL PROTEIN
MJ1187

(Methanocaldococcus
jannaschii) 		PF03747
(ADP_ribosyl_GH) 		5 ALA A 149
GLY A  77
ILE A   8
GLY A 132
TYR A 129
 None
 1.12A 4r29D-1t5jA:
undetectable		 4r29D-1t5jA:
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 SER A 136
GLY A 244
ILE A 186
ALA A 255
GLY A 250
 None
SO4  A 373 (-3.5A)
None
None
None
 1.11A 4r29D-1to6A:
undetectable		 4r29D-1to6A:
22.16
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		5 GLY A 599
ILE A 626
ALA A 619
MET A 616
GLU A 558
 None
 1.06A 4r29D-1ulvA:
undetectable		 4r29D-1ulvA:
12.18
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.
1umb 2-OXO ACID
DEHYDROGENASE ALPHA
SUBUNIT
2-OXO ACID
DEHYDROGENASE BETA
SUBUNIT

(Thermus
thermophilus;
Thermus
thermophilus) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 154
GLY B  65
GLN B  97
ILE A 146
ALA A 177
 None
None
None
TDP  A1402 (-4.1A)
TDP  A1402 (-3.9A)
 1.02A 4r29D-1umbA:
undetectable		 4r29D-1umbA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v7v CHITOBIOSE
PHOSPHORYLASE

(Vibrio
proteolyticus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 ALA A 228
GLY A 218
ALA A 238
GLY A 211
TYR A 209
 None
 1.06A 4r29D-1v7vA:
undetectable		 4r29D-1v7vA:
15.60
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.
2aw5 NADP-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 ALA A 413
SER A 407
GLY A 433
ILE A 429
ALA A 428
 None
 0.99A 4r29D-2aw5A:
undetectable		 4r29D-2aw5A:
14.60
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.
2c7z 3-KETOACYL-COA
THIOLASE 2

(Arabidopsis
thaliana) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ALA A  41
GLN A  43
ILE A 341
ALA A 338
GLY A 336
 None
 0.99A 4r29D-2c7zA:
undetectable		 4r29D-2c7zA:
19.16
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.
2dg7 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 GLY A  58
ILE A 162
ALA A 102
GLY A 100
GLU A  18
 None
 1.10A 4r29D-2dg7A:
2.4		 4r29D-2dg7A:
19.13
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.
2dna UNNAMED PROTEIN
PRODUCT

(Mus musculus) 		PF00627
(UBA) 		5 ALA A  36
ALA A  28
MET A  29
GLY A  30
PHE A  31
 None
 1.06A 4r29D-2dnaA:
undetectable		 4r29D-2dnaA:
17.37
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.
2pjr PROTEIN (HELICASE
PCRA)
PROTEIN (HELICASE
PCRA)

(Geobacillus
stearothermophilus;
Geobacillus
stearothermophilus) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
PF13361
(UvrD_C) 		5 ALA B 620
ARG B 623
GLY B 579
ILE A 340
ALA A 337
 None
 0.92A 4r29D-2pjrB:
undetectable		 4r29D-2pjrB:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q27 OXALYL-COA
DECARBOXYLASE

(Escherichia
coli) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 SER A 154
GLY A 160
ALA A  60
GLY A  58
TYR A  27
 None
 0.98A 4r29D-2q27A:
undetectable		 4r29D-2q27A:
17.11
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.
2qjg PUTATIVE ALDOLASE
MJ0400

(Methanocaldococcus
jannaschii) 		PF01791
(DeoC) 		5 SER A  37
GLY A  35
ILE A  29
ALA A 235
GLY A 237
 F2P  A 501 (-3.2A)
None
None
None
F2P  A 501 (-3.6A)
 1.09A 4r29D-2qjgA:
undetectable		 4r29D-2qjgA:
21.91
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		5 ARG A 401
GLY A 393
ILE A  81
GLY A 422
GLU A 426
 None
None
None
None
EDO  A1962 ( 4.4A)
 1.12A 4r29D-2r4jA:
undetectable		 4r29D-2r4jA:
16.77
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.
2vhe ACETYLTRANSFERASE

(Campylobacter
jejuni) 		PF00132
(Hexapep) 		5 ALA A   2
ALA A  23
MET A  26
GLY A  27
GLU A   5
 None
 1.01A 4r29D-2vheA:
undetectable		 4r29D-2vheA:
24.61
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.
2vxy CELL DIVISION
PROTEIN FTSZ

(Bacillus
subtilis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A  71
GLY A  20
ILE A 151
MET A 105
GLY A 106
 CIT  A 401 (-3.5A)
CIT  A 401 (-3.5A)
None
None
None
 1.06A 4r29D-2vxyA:
undetectable		 4r29D-2vxyA:
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.
2wgh RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE SUBUNIT

(Homo sapiens) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC) 		5 ALA A 608
GLY A 507
ILE A 702
ALA A 600
GLY A 504
 None
 0.88A 4r29D-2wghA:
undetectable		 4r29D-2wghA:
16.64
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.
2ww9 SEC SIXTY-ONE
PROTEIN HOMOLOG
PROTEIN TRANSPORT
PROTEIN SEB2

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00344
(SecY)
PF10559
(Plug_translocon)
PF03911
(Sec61_beta) 		5 GLY A 159
GLN A 156
ILE C  76
GLY C  70
PHE C  71
 None
 1.11A 4r29D-2ww9A:
undetectable		 4r29D-2ww9A:
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.
2z02 PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE

(Methanocaldococcus
jannaschii) 		PF01259
(SAICAR_synt) 		5 ALA A  19
GLY A  53
ILE A  86
ALA A  87
GLU A 185
 ATP  A1527 (-4.0A)
None
None
ATP  A1527 ( 4.3A)
ATP  A1527 (-3.4A)
 1.11A 4r29D-2z02A:
undetectable		 4r29D-2z02A:
22.18
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.
3a14 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Thermotoga
maritima) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 ALA A 115
GLY A  16
GLN A  18
ALA A 194
GLU A 118
 NDP  A3001 (-3.9A)
None
None
None
NDP  A3001 (-3.7A)
 1.09A 4r29D-3a14A:
undetectable		 4r29D-3a14A:
23.85
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.
3b8b CYSQ, SULFITE
SYNTHESIS PATHWAY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00459
(Inositol_P) 		5 ALA A  39
ILE A 201
GLY A  85
PHE A  96
GLU A  61
 None
None
SO4  A 269 ( 4.2A)
None
None
 1.10A 4r29D-3b8bA:
undetectable		 4r29D-3b8bA:
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.
3bpt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE

(Homo sapiens) 		PF16113
(ECH_2) 		5 GLY A 199
ILE A 142
ALA A  96
MET A 144
GLY A 145
 None
None
QUE  A 501 ( 4.0A)
None
HIU  A 502 ( 3.7A)
 1.04A 4r29D-3bptA:
undetectable		 4r29D-3bptA:
22.85
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.
3chx PMOB

(Methylosinus
trichosporium) 		PF04744
(Monooxygenase_B) 		5 ALA A 147
GLY A  76
ALA A 332
GLY A 334
GLU A  42
 None
None
None
None
CU  A 712 (-3.4A)
 1.08A 4r29D-3chxA:
undetectable		 4r29D-3chxA:
18.32
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.
3fhc ATP-DEPENDENT RNA
HELICASE DDX19B

(Homo sapiens) 		PF00270
(DEAD) 		6 SER B 116
GLY B 143
ALA B 109
MET B 110
GLY B 111
PHE B 112
 None
 1.47A 4r29D-3fhcB:
undetectable		 4r29D-3fhcB:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fw8 RETICULINE OXIDASE

(Eschscholzia
californica) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 SER A 280
GLY A 391
ILE A 399
MET A 396
GLY A 394
 None
 1.12A 4r29D-3fw8A:
undetectable		 4r29D-3fw8A:
18.11
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.
3gxo MMCR

(Streptomyces
lavendulae) 		PF00891
(Methyltransf_2) 		5 ALA A 221
GLY A 191
ALA A 162
MET A 163
GLY A 164
 None
SAH  A 350 (-3.6A)
MQA  A 351 (-3.7A)
SAH  A 350 ( 3.7A)
None
 1.07A 4r29D-3gxoA:
undetectable		 4r29D-3gxoA:
19.10
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.
3la4 UREASE

(Canavalia
ensiformis) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		5 GLY A 326
ILE A 194
ALA A 195
GLY A 197
GLU A 395
 None
 1.11A 4r29D-3la4A:
undetectable		 4r29D-3la4A:
13.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lca PROTEIN TOM71

(Saccharomyces
cerevisiae) 		PF00515
(TPR_1)
PF13181
(TPR_8)
PF14559
(TPR_19) 		5 ALA A 438
GLY A 419
GLN A 420
ALA A 453
PHE A 435
 None
None
GOL  A   1 (-3.2A)
None
None
 1.03A 4r29D-3lcaA:
undetectable		 4r29D-3lcaA:
19.10
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.
3lj0 SERINE/THREONINE-PRO
TEIN
KINASE/ENDORIBONUCLE
ASE IRE1

(Saccharomyces
cerevisiae) 		PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A) 		5 ILE A1069
ALA A1070
MET A1073
GLY A1074
PHE A1080
 None
 0.91A 4r29D-3lj0A:
undetectable		 4r29D-3lj0A:
22.27
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.
3lkv UNCHARACTERIZED
CONSERVED DOMAIN
PROTEIN

(Vibrio cholerae) 		PF04392
(ABC_sub_bind) 		5 ALA A  43
ALA A 245
GLY A 259
GLU A 251
TYR A 249
 None
 0.90A 4r29D-3lkvA:
undetectable		 4r29D-3lkvA:
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.
3mcp GLUCOKINASE

(Parabacteroides
distasonis) 		PF00480
(ROK) 		5 SER A 343
GLY A 128
ILE A  25
MET A 353
GLY A 354
 None
 0.98A 4r29D-3mcpA:
undetectable		 4r29D-3mcpA:
22.81
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.
3mpn TRANSPORTER

(Aquifex
aeolicus) 		PF00209
(SNF) 		5 ALA A  79
GLY A  73
GLN A  72
ALA A  64
GLY A  66
 BOG  A   1 ( 4.1A)
None
None
None
None
 0.90A 4r29D-3mpnA:
undetectable		 4r29D-3mpnA:
18.31
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.
3nda SERPIN-2

(Ixodes ricinus) 		PF00079
(Serpin) 		5 ALA A  10
GLY A  59
ALA A  40
MET A  41
GLY A  42
 None
 1.01A 4r29D-3ndaA:
undetectable		 4r29D-3ndaA:
21.13
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 SER A 435
GLY A 433
ILE A 395
GLY A 382
GLU A 339
 None
 1.04A 4r29D-3oc4A:
undetectable		 4r29D-3oc4A:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p7m MALATE DEHYDROGENASE

(Francisella
tularensis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ALA A 151
SER A 150
GLY A 146
ALA A 243
GLY A 239
 None
 0.98A 4r29D-3p7mA:
undetectable		 4r29D-3p7mA:
22.29
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.
3q1y LIN2199 PROTEIN

(Listeria
innocua) 		PF00294
(PfkB) 		5 ALA A 281
SER A 280
GLY A 276
ILE A  52
GLY A 255
 K  A   1 (-4.6A)
None
None
None
None
 0.87A 4r29D-3q1yA:
undetectable		 4r29D-3q1yA:
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.
3qyr ECHA16_2

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 ALA A  97
GLY A 102
ILE A  53
GLY A  56
PHE A  61
 None
 1.09A 4r29D-3qyrA:
undetectable		 4r29D-3qyrA:
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.
3skp SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 ALA A 428
GLY A 459
ILE A 471
MET A 464
GLY A 465
 None
 1.08A 4r29D-3skpA:
undetectable		 4r29D-3skpA:
18.95
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.
3sqg METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT

(uncultured
archaeon) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 SER B 352
GLY B 325
GLN B 329
GLY B 309
GLU B 239
 None
 0.80A 4r29D-3sqgB:
undetectable		 4r29D-3sqgB:
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 GLY A  68
GLN A  42
ILE A  28
ALA A  24
GLU A 234
 IAS  A  67 ( 2.4A)
None
None
None
None
 1.03A 4r29D-3swdA:
undetectable		 4r29D-3swdA:
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.
3t0o RIBONUCLEASE T2

(Homo sapiens) 		PF00445
(Ribonuclease_T2) 		5 GLN A  41
ILE A 182
GLY A 197
GLU A  45
TYR A 248
 None
 1.10A 4r29D-3t0oA:
undetectable		 4r29D-3t0oA:
21.81
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.
3tcr MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN

(Mycobacteroides
abscessus) 		PF00994
(MoCF_biosynth) 		5 GLY A 150
ILE A 114
ALA A 137
GLY A 135
GLU A 101
 None
 1.11A 4r29D-3tcrA:
undetectable		 4r29D-3tcrA:
19.59
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.
3v4p INTEGRIN ALPHA-4

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 ALA A 419
GLY A 387
ILE A 369
ALA A 354
GLY A 356
 None
 1.05A 4r29D-3v4pA:
undetectable		 4r29D-3v4pA:
17.82
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.
4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E

(Streptomyces
cinnabarigriseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 260
SER A 230
GLY A 407
GLN A 405
GLY A 441
 None
NAP  A1447 (-3.6A)
None
NAP  A1447 (-3.5A)
None
 1.07A 4r29D-4a0sA:
undetectable		 4r29D-4a0sA:
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.
4d8u D-CYSTEINE
DESULFHYDRASE

(Salmonella
enterica) 		PF00291
(PALP) 		5 ALA A  60
ILE A 238
ALA A 163
GLY A 165
PHE A  57
 None
 1.00A 4r29D-4d8uA:
undetectable		 4r29D-4d8uA:
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.
4dd5 ACETYL-COA
ACETYLTRANSFERASE

(Clostridioides
difficile) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ALA A 348
SER A 252
ILE A  91
GLY A 359
GLU A 319
 None
 1.02A 4r29D-4dd5A:
undetectable		 4r29D-4dd5A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fl0 AMINOTRANSFERASE
ALD1

(Arabidopsis
thaliana) 		PF00155
(Aminotran_1_2) 		5 ALA A 253
SER A 280
GLY A 294
ILE A  88
GLY A 287
 PLP  A 501 (-3.5A)
None
None
None
None
 0.82A 4r29D-4fl0A:
undetectable		 4r29D-4fl0A:
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.
4gl3 PUTATIVE
GLUCOAMYLASE

(Bacteroides
uniformis) 		PF10091
(Glycoamylase) 		5 ALA A 403
GLY A 407
ILE A 223
ALA A 153
PHE A  84
 None
 1.10A 4r29D-4gl3A:
undetectable		 4r29D-4gl3A:
19.76
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.
4hdt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE

(Mycolicibacterium
thermoresistibile) 		PF16113
(ECH_2) 		5 GLY A 169
ILE A 112
ALA A  66
MET A 114
GLY A 115
 None
 1.03A 4r29D-4hdtA:
undetectable		 4r29D-4hdtA:
19.83
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.
4inf METAL-DEPENDENT
HYDROLASE

(Novosphingobium
aromaticivorans) 		PF04909
(Amidohydro_2) 		5 SER A  91
GLY A  93
GLN A  95
ILE A 143
GLY A 129
 None
 0.94A 4r29D-4infA:
undetectable		 4r29D-4infA:
21.16
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.
4ix1 HYPOTHETICAL PROTEIN

(Rhodococcus
opacus) 		no annotation 5 ALA A 234
SER A 118
GLY A 116
ALA A 210
GLY A 208
 None
 1.10A 4r29D-4ix1A:
undetectable		 4r29D-4ix1A:
22.39
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.
4jq9 DIHYDROLIPOYL
DEHYDROGENASE

(Escherichia
coli) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ARG A 296
GLY A 316
GLN A 317
GLY A 293
PHE A 294
 SO4  A 511 (-2.2A)
SO4  A 511 (-3.0A)
SO4  A 511 (-4.0A)
None
SO4  A 511 (-3.5A)
 1.11A 4r29D-4jq9A:
undetectable		 4r29D-4jq9A:
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.
4kjr CATION EXCHANGER
YFKE

(Bacillus
subtilis) 		PF01699
(Na_Ca_ex) 		5 ALA A 254
SER A  42
GLY A  45
ILE A 270
ALA A 271
 None
 1.10A 4r29D-4kjrA:
undetectable		 4r29D-4kjrA:
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.
4kn5 METHYLTHIOADENOSINE
NUCLEOSIDASE

(Weissella
paramesenteroides) 		PF01048
(PNP_UDP_1) 		5 ALA A 191
SER A 126
ILE A 196
ALA A  77
GLY A  75
 None
 1.10A 4r29D-4kn5A:
undetectable		 4r29D-4kn5A:
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.
4mou ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Paenarthrobacter
aurescens) 		PF00378
(ECH_1) 		5 ALA A 145
GLY A 175
ALA A  72
MET A 119
GLY A 120
 None
 1.01A 4r29D-4mouA:
undetectable		 4r29D-4mouA:
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.
4o48 UNCHARACTERIZED
PROTEIN

(Cavia porcellus) 		PF01112
(Asparaginase_2) 		5 ALA A 287
GLY A  26
ILE A 102
ALA A 183
GLY A 170
 None
 1.11A 4r29D-4o48A:
0.4		 4r29D-4o48A:
19.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r29 UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		no annotation 12 ALA A  92
SER A  98
ARG A 107
GLY A 110
GLN A 111
ILE A 194
ALA A 195
MET A 198
GLY A 199
PHE A 202
GLU A 208
TYR A 212
 SAM  A 301 (-3.7A)
SAM  A 301 (-2.6A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.3A)
GOL  A 302 ( 4.0A)
None
SAM  A 301 (-3.5A)
SAM  A 301 (-4.5A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.8A)
None
SAM  A 301 (-3.7A)
 0.25A 4r29D-4r29A:
32.6		 4r29D-4r29A:
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.
4u39 CELL DIVISION
PROTEIN FTSZ

(Bacillus
subtilis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A  71
GLY A  20
ILE A 151
MET A 105
GLY A 106
 None
PO4  A 401 (-3.3A)
None
None
None
 0.97A 4r29D-4u39A:
undetectable		 4r29D-4u39A:
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.
4upe NICKEL-DEPENDENT
HYDROGENASE LARGE
SUBUNIT

(Desulfovibrio
fructosivorans) 		PF00374
(NiFeSe_Hases) 		5 ALA Q 274
GLY Q 423
ILE Q 434
ALA Q 433
GLY Q 429
 None
 0.96A 4r29D-4upeQ:
0.9		 4r29D-4upeQ:
16.70
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.
4w82 FATTY ACID SYNTHASE

(Homo sapiens) 		PF00107
(ADH_zinc_N) 		5 SER A1675
GLY A1678
ILE A1576
ALA A1844
GLY A1846
 CL  A1901 (-4.6A)
None
None
None
None
 1.07A 4r29D-4w82A:
undetectable		 4r29D-4w82A:
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.
4y7k LARGE CONDUCTANCE
MECHANOSENSITIVE
CHANNEL
PROTEIN,RIBOFLAVIN
SYNTHASE

(Methanocaldococcus
jannaschii;
Methanosarcina
acetivorans) 		PF00885
(DMRL_synthase)
PF01741
(MscL) 		5 ALA A  84
ILE A  21
ALA A  22
MET A  25
GLY A  26
 None
 0.91A 4r29D-4y7kA:
undetectable		 4r29D-4y7kA:
19.72
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.
5ah4 DNA POLYMERASE III
SUBUNIT BETA

(Mycolicibacterium
smegmatis) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 ALA A 269
ILE A 295
ALA A 332
MET A 297
PHE A 299
 NA  A1398 ( 4.2A)
None
None
None
None
 1.08A 4r29D-5ah4A:
undetectable		 4r29D-5ah4A:
18.34
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.
5ahk ACETOLACTATE
SYNTHASE II, LARGE
SUBUNIT

(Pseudomonas
protegens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A  84
GLN A  49
ILE A 430
ALA A 429
GLU A 249
 None
 1.05A 4r29D-5ahkA:
undetectable		 4r29D-5ahkA:
17.25
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.
5d8w ENDOGLUCANASE

(Ganoderma
lucidum) 		PF00150
(Cellulase) 		5 ALA A  44
GLY A  87
ILE A 147
GLU A 100
TYR A 101
 None
 1.01A 4r29D-5d8wA:
undetectable		 4r29D-5d8wA:
16.81
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.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis) 		PF00144
(Beta-lactamase) 		5 SER A 145
ILE A 126
ALA A 127
MET A 125
PHE A 115
 None
 1.09A 4r29D-5e2hA:
undetectable		 4r29D-5e2hA:
22.12
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.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 ALA A 578
GLY A 546
ILE A 528
ALA A 515
GLY A 517
 None
 1.03A 4r29D-5e6sA:
undetectable		 4r29D-5e6sA:
14.00
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.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 ALA A 401
GLY A 396
GLN A 210
ALA A 346
GLY A 344
 None
None
None
5SV  A 701 (-4.7A)
5SV  A 701 (-3.6A)
 1.10A 4r29D-5ey8A:
undetectable		 4r29D-5ey8A:
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.
5fnu KELCH-LIKE
ECH-ASSOCIATED
PROTEIN 1

(Mus musculus) 		PF01344
(Kelch_1) 		5 ALA A 556
GLY A 524
ILE A 519
ALA A 466
GLY A 464
 L6I  A1615 (-2.9A)
None
None
None
None
 1.06A 4r29D-5fnuA:
undetectable		 4r29D-5fnuA:
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.
5g4i PHOSPHOLYASE

(Paenarthrobacter
aurescens) 		PF00202
(Aminotran_3) 		5 ALA A 291
GLY A 280
ILE A  78
ALA A 320
GLY A 322
 None
 1.05A 4r29D-5g4iA:
undetectable		 4r29D-5g4iA:
18.82
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.
5gvh ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[FMN]

(Thermotoga
maritima) 		PF03060
(NMO) 		5 ALA A  31
ILE A 173
MET A 192
GLY A 193
PHE A 196
 None
None
None
FMN  A 402 (-3.4A)
None
 1.01A 4r29D-5gvhA:
undetectable		 4r29D-5gvhA:
21.75
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.
5h36 UNCHARACTERIZED
PROTEIN TRIC

(Rhodobacter
sphaeroides) 		no annotation 5 GLY E  46
ILE E 120
ALA E 121
MET E 124
GLY E 125
 None
 0.76A 4r29D-5h36E:
1.3		 4r29D-5h36E:
18.78
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.
5h36 UNCHARACTERIZED
PROTEIN TRIC

(Rhodobacter
sphaeroides) 		no annotation 5 GLY E  47
ILE E 120
ALA E 121
MET E 124
GLY E 125
 None
 0.83A 4r29D-5h36E:
1.3		 4r29D-5h36E:
18.78
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.
5hm9 MAMO PROTEASE DOMAIN

(Magnetospirillum
magneticum) 		PF13365
(Trypsin_2) 		5 ALA A 174
SER A 172
ILE A  68
ALA A  59
GLY A 183
 None
 1.12A 4r29D-5hm9A:
undetectable		 4r29D-5hm9A:
21.22
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Pseudomonas
aeruginosa) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		5 ALA A 776
GLY A 664
ILE A 870
ALA A 768
GLY A 661
 None
 0.98A 4r29D-5im3A:
undetectable		 4r29D-5im3A:
12.29
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER

(Shigella
flexneri) 		PF02395
(Peptidase_S6) 		5 ALA A   1
ARG A 145
GLY A 172
ILE A  55
GLY A  63
 None
 1.12A 4r29D-5j44A:
undetectable		 4r29D-5j44A:
13.28
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.
5jfy DEOXYCYTIDINE
DEAMINASE

(Brassica
oleracea) 		PF00383
(dCMP_cyt_deam_1) 		5 SER A 120
ILE A 135
ALA A 136
GLY A 138
PHE A 139
 None
HEZ  A 204 ( 3.9A)
None
None
None
 1.01A 4r29D-5jfyA:
undetectable		 4r29D-5jfyA:
20.27
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.
5k1r BURKHOLDERIA
PSEUDOMALLEI
SPHINGOSINE-1-PHOSPH
ATE LYASE BPSS2021

(Burkholderia
pseudomallei) 		PF00282
(Pyridoxal_deC) 		5 ALA A 338
GLY A 244
ILE A 265
ALA A 267
GLY A 237
 None
 1.11A 4r29D-5k1rA:
undetectable		 4r29D-5k1rA:
18.20
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.
5kdj F5/8 TYPE C DOMAIN
PROTEIN

(Clostridium
perfringens) 		no annotation 5 ILE B 692
ALA B 693
MET B 696
GLY B 697
PHE B 701
 None
 1.02A 4r29D-5kdjB:
undetectable		 4r29D-5kdjB:
15.09
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.
5kds F5/8 TYPE C DOMAIN
PROTEIN

(Clostridium
perfringens) 		PF13402
(Peptidase_M60) 		5 ILE A 692
ALA A 693
MET A 696
GLY A 697
PHE A 701
 None
 1.06A 4r29D-5kdsA:
undetectable		 4r29D-5kdsA:
18.87
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.
5mdx PHOTOSYSTEM II
PROTEIN D1
PHOTOSYSTEM II CP43
REACTION CENTER
PROTEIN

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF00124
(Photo_RC)
PF00421
(PSII) 		5 ALA A 336
GLY C 353
ILE A  89
GLY A  62
GLU A  65
 None
 1.12A 4r29D-5mdxA:
undetectable		 4r29D-5mdxA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nlm INDOXYL
UDP-GLUCOSYLTRANSFER
ASE

(Persicaria
tinctoria) 		no annotation 5 SER A 274
GLY A 365
ILE A 425
ALA A 426
GLY A 430
 None
MG  A1003 (-4.1A)
None
None
None
 0.96A 4r29D-5nlmA:
undetectable		 4r29D-5nlmA:
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 GLY A4104
ILE A4069
ALA A4070
GLY A4072
GLU A1965
 None
 1.02A 4r29D-5nugA:
undetectable		 4r29D-5nugA:
4.00
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.
5tus RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE SUBUNIT

(Homo sapiens) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		5 ALA A 608
GLY A 507
ILE A 702
ALA A 600
GLY A 504
 None
 0.84A 4r29D-5tusA:
undetectable		 4r29D-5tusA:
15.45
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.
5u1o GLUTATHIONE
REDUCTASE

(Vibrio
parahaemolyticus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A  24
SER A  23
GLY A  19
ILE A 274
ALA A 119
 None
None
FAD  A 501 (-3.7A)
FAD  A 501 (-4.6A)
FAD  A 501 (-3.7A)
 1.10A 4r29D-5u1oA:
undetectable		 4r29D-5u1oA:
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.
5v2i GLYCOSYLASPARAGINASE

(Elizabethkingia
meningoseptica) 		PF01112
(Asparaginase_2) 		5 ALA A 259
GLY A 198
ILE A  76
MET A  70
GLY A 166
 None
 1.04A 4r29D-5v2iA:
undetectable		 4r29D-5v2iA:
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.
5vsj ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE
1

(Streptomyces
coelicolor) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		5 GLY A 509
ALA A 244
MET A 245
GLY A 246
PHE A 247
 None
 1.01A 4r29D-5vsjA:
undetectable		 4r29D-5vsjA:
13.67
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.
5xmd EPOXIDE HYDROLASE A

(Vigna radiata) 		no annotation 5 ALA A  99
GLN A  43
ILE A   4
ALA A  19
PHE A  29
 None
 1.09A 4r29D-5xmdA:
undetectable		 4r29D-5xmdA:
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.
5xvh 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
NAD-BINDING PROTEIN

(Pyrobaculum
calidifontis) 		no annotation 5 ALA A 105
GLY A 164
GLN A 167
ILE A 134
GLU A 114
 None
 1.07A 4r29D-5xvhA:
undetectable		 4r29D-5xvhA:
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.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 5 ALA A 200
GLY A 308
ILE A 161
ALA A 162
GLY A 166
 None
 0.96A 4r29D-6bogA:
undetectable		 4r29D-6bogA:
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 ALPHA

(Mycobacterium
tuberculosis) 		no annotation 5 ALA A  63
SER A  62
GLY A  58
ALA A  34
MET A  33
 None
 1.12A 4r29D-6conA:
undetectable		 4r29D-6conA:
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.
6cza -

(-) 		no annotation 5 GLY A 398
ILE A 357
ALA A 358
MET A 361
GLY A 362
 None
 0.83A 4r29D-6czaA:
undetectable		 4r29D-6czaA:
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.
6exs PEPTIDE ABC
TRANSPORTER PERMEASE

(Staphylococcus
hominis) 		no annotation 5 SER A 165
ILE A 107
ALA A 198
MET A 197
GLY A 196
 None
 0.97A 4r29D-6exsA:
undetectable		 4r29D-6exsA:
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.
1c0i D-AMINO ACID OXIDASE

(Rhodotorula
toruloides) 		PF01266
(DAO) 		3 ARG A1288
GLU A1297
TYR A1331
 None
 0.92A 4r29D-1c0iA:
0.0		 4r29D-1c0iA:
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.
1ea6 PMS1 PROTEIN HOMOLOG
2

(Homo sapiens) 		PF01119
(DNA_mis_repair)
PF13589
(HATPase_c_3) 		3 ARG A 151
GLU A  67
TYR A 149
 None
 1.00A 4r29D-1ea6A:
0.0		 4r29D-1ea6A:
21.20
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.
1f5a POLY(A) POLYMERASE

(Bos taurus) 		PF01909
(NTP_transf_2)
PF04926
(PAP_RNA-bind)
PF04928
(PAP_central) 		3 ARG A  61
GLU A  55
TYR A 103
 None
 0.95A 4r29D-1f5aA:
0.0		 4r29D-1f5aA:
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.
1idj PECTIN LYASE A

(Aspergillus
niger) 		PF00544
(Pec_lyase_C) 		3 ARG A 236
GLU A  86
TYR A 211
 None
 0.85A 4r29D-1idjA:
0.0		 4r29D-1idjA:
21.28
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.
1kfi PHOSPHOGLUCOMUTASE 1

(Paramecium
tetraurelia) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A 449
GLU A 392
TYR A 529
 None
 0.99A 4r29D-1kfiA:
0.0		 4r29D-1kfiA:
17.48
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.
1ltl DNA REPLICATION
INITIATOR
(CDC21/CDC54)

(Methanothermobacter
thermautotrophicus) 		PF14551
(MCM_N)
PF17207
(MCM_OB) 		3 ARG A  37
GLU A 170
TYR A  33
 None
 0.92A 4r29D-1ltlA:
0.0		 4r29D-1ltlA:
21.11
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.
1lwu FIBRINOGEN BETA
CHAIN

(Petromyzon
marinus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		3 ARG B 285
GLU B 311
TYR B 290
 None
 0.98A 4r29D-1lwuB:
0.0		 4r29D-1lwuB:
18.34
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.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		3 ARG A 422
GLU A 391
TYR A 418
 None
 0.91A 4r29D-1obbA:
0.0		 4r29D-1obbA:
19.83
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.
1p27 MAGO NASHI PROTEIN
HOMOLOG
RNA-BINDING PROTEIN
8A

(Homo sapiens;
Homo sapiens) 		PF02792
(Mago_nashi)
PF00076
(RRM_1) 		3 ARG B 109
GLU A 117
TYR A 124
 None
 0.81A 4r29D-1p27B:
undetectable		 4r29D-1p27B:
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.
1u2b CYTOHESIN 3

(Mus musculus) 		PF00169
(PH) 		3 ARG A 285
GLU A 346
TYR A 296
 SO4  A 501 (-3.9A)
None
SO4  A 501 (-4.8A)
 1.00A 4r29D-1u2bA:
undetectable		 4r29D-1u2bA:
21.83
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.
1yfo RECEPTOR PROTEIN
TYROSINE PHOSPHATASE
ALPHA

(Mus musculus) 		PF00102
(Y_phosphatase) 		3 ARG A 261
GLU A 338
TYR A 262
 None
 1.00A 4r29D-1yfoA:
undetectable		 4r29D-1yfoA:
20.58
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.
1z01 2-OXO-1,2-DIHYDROQUI
NOLINE
8-MONOOXYGENASE,
OXYGENASE COMPONENT

(Pseudomonas
putida) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		3 ARG A 210
GLU A 385
TYR A  33
 None
 0.93A 4r29D-1z01A:
undetectable		 4r29D-1z01A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2atc ASPARTATE
CARBAMOYLTRANSFERASE
, CATALYTIC CHAIN

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 ARG A 183
GLU A 217
TYR A 185
 None
 0.95A 4r29D-2atcA:
undetectable		 4r29D-2atcA:
20.77
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.
2c0n A197

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 3 ARG A 184
GLU A 105
TYR A  90
 None
 1.01A 4r29D-2c0nA:
undetectable		 4r29D-2c0nA:
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.
2cgj L-RHAMNULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 ARG A 106
GLU A 149
TYR A  48
 None
 0.87A 4r29D-2cgjA:
undetectable		 4r29D-2cgjA:
17.90
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.
2dao TRANSCRIPTION FACTOR
ETV6

(Homo sapiens) 		PF00178
(Ets) 		3 ARG A  69
GLU A 111
TYR A  72
 None
 0.94A 4r29D-2daoA:
undetectable		 4r29D-2daoA:
16.52
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.
2f7l 455AA LONG
HYPOTHETICAL
PHOSPHO-SUGAR MUTASE

(Sulfurisphaera
tokodaii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A  11
GLU A 216
TYR A 103
 None
 0.98A 4r29D-2f7lA:
undetectable		 4r29D-2f7lA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fdb FIBROBLAST GROWTH
FACTOR 8 ISOFORM B

(Homo sapiens) 		PF00167
(FGF) 		3 ARG M 177
GLU M  78
TYR M  57
 None
 1.02A 4r29D-2fdbM:
undetectable		 4r29D-2fdbM:
21.10
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.
2fuv PHOSPHOGLUCOMUTASE

(Salmonella
enterica) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A 447
GLU A 390
TYR A 518
 None
 0.73A 4r29D-2fuvA:
undetectable		 4r29D-2fuvA:
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.
2o2k METHIONINE SYNTHASE

(Homo sapiens) 		PF02965
(Met_synt_B12) 		3 ARG A1172
GLU A1140
TYR A1219
 None
 0.96A 4r29D-2o2kA:
undetectable		 4r29D-2o2kA:
21.85
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.
2q9u A-TYPE FLAVOPROTEIN

(Giardia
intestinalis) 		no annotation 3 ARG A 235
GLU A  12
TYR A 225
 None
 0.94A 4r29D-2q9uA:
undetectable		 4r29D-2q9uA:
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.
2qeu PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE

(Paraburkholderia
xenovorans) 		PF02627
(CMD) 		3 ARG A  49
GLU A  80
TYR A  45
 CIT  A 146 (-3.8A)
CIT  A 146 ( 3.0A)
CIT  A 146 (-4.7A)
 0.96A 4r29D-2qeuA:
undetectable		 4r29D-2qeuA:
21.55
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.
2xax RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
SUBUNIT ALPHA

(Escherichia
coli) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		3 ARG A  72
GLU A 671
TYR A 659
 None
 0.76A 4r29D-2xaxA:
undetectable		 4r29D-2xaxA:
15.77
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.
2ysk HYPOTHETICAL PROTEIN
TTHA1432

(Thermus
thermophilus) 		PF10025
(DUF2267) 		3 ARG A  67
GLU A 126
TYR A  71
 SO4  A 146 ( 4.6A)
None
None
 0.86A 4r29D-2yskA:
undetectable		 4r29D-2yskA:
19.47
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.
3a31 PROBABLE
THREONYL-TRNA
SYNTHETASE 1

(Aeropyrum
pernix) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon) 		3 ARG A  52
GLU A  72
TYR A  53
 None
 0.87A 4r29D-3a31A:
undetectable		 4r29D-3a31A:
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.
3d5t MALATE DEHYDROGENASE

(Burkholderia
pseudomallei) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 ARG A 319
GLU A 277
TYR A 139
 None
 0.95A 4r29D-3d5tA:
undetectable		 4r29D-3d5tA:
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 ARG A 317
GLU A 279
TYR A 284
 None
 0.87A 4r29D-3dljA:
undetectable		 4r29D-3dljA:
18.12
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.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		3 ARG D 136
GLU D 129
TYR D 123
 None
 1.00A 4r29D-3dzuD:
undetectable		 4r29D-3dzuD:
19.61
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.
3eck PROTEIN
(HOMOPROTOCATECHUATE
2,3-DIOXYGENASE)

(Brevibacterium
fuscum) 		PF00903
(Glyoxalase) 		3 ARG A 265
GLU A 329
TYR A 257
 None
 0.93A 4r29D-3eckA:
undetectable		 4r29D-3eckA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fbs OXIDOREDUCTASE

(Agrobacterium
fabrum) 		PF07992
(Pyr_redox_2) 		3 ARG A  36
GLU A  61
TYR A  12
 None
None
FAD  A 298 (-4.7A)
 0.98A 4r29D-3fbsA:
undetectable		 4r29D-3fbsA:
21.50
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.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli) 		PF07969
(Amidohydro_3) 		3 ARG A 174
GLU A 166
TYR A 207
 None
 0.92A 4r29D-3g77A:
undetectable		 4r29D-3g77A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gcf TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE
1,9A-DIOXYGENASE

(Nocardioides
aromaticivorans) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		3 ARG A 178
GLU A 357
TYR A  24
 None
 0.89A 4r29D-3gcfA:
undetectable		 4r29D-3gcfA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gkq TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE
1,9A-DIOXYGENASE

(Sphingomonas
sp. KA1) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		3 ARG A 175
GLU A 354
TYR A  21
 None
 0.92A 4r29D-3gkqA:
undetectable		 4r29D-3gkqA:
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.
3gzf REPLICASE
POLYPROTEIN 1AB

(Alphacoronavirus
1) 		PF16348
(Corona_NSP4_C) 		3 ARG A  79
GLU A  27
TYR A  75
 None
 0.88A 4r29D-3gzfA:
undetectable		 4r29D-3gzfA:
15.77
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.
3j04 MYOSIN-11

(Gallus gallus) 		PF00063
(Myosin_head)
PF00612
(IQ)
PF01576
(Myosin_tail_1)
PF02736
(Myosin_N) 		3 ARG A 733
GLU A 786
TYR A 734
 None
 0.90A 4r29D-3j04A:
undetectable		 4r29D-3j04A:
14.24
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.
3jv7 ADH-A

(Rhodococcus
ruber) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ARG A 298
GLU A 303
TYR A  87
 None
 0.83A 4r29D-3jv7A:
undetectable		 4r29D-3jv7A:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kao TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE

(Staphylococcus
aureus) 		PF01791
(DeoC) 		3 ARG A  29
GLU A 110
TYR A  73
 SO4  A 327 (-4.6A)
None
None
 0.86A 4r29D-3kaoA:
undetectable		 4r29D-3kaoA:
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.
3kdn RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Thermococcus
kodakarensis) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ARG A 205
GLU A 192
TYR A 168
 None
MG  A 500 ( 2.5A)
None
 0.96A 4r29D-3kdnA:
undetectable		 4r29D-3kdnA:
18.39
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.
3l91 ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ
SUBUNIT BETA

(Pseudomonas
aeruginosa) 		PF01804
(Penicil_amidase) 		3 ARG B 296
GLU B 441
TYR B 362
 None
 0.88A 4r29D-3l91B:
undetectable		 4r29D-3l91B:
16.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mc6 SPHINGOSINE-1-PHOSPH
ATE LYASE

(Saccharomyces
cerevisiae) 		PF00282
(Pyridoxal_deC) 		3 ARG C 475
GLU C 354
TYR C 476
 None
 0.96A 4r29D-3mc6C:
undetectable		 4r29D-3mc6C:
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.
3myo TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE 1

(Streptococcus
pyogenes) 		PF01791
(DeoC) 		3 ARG A  28
GLU A 109
TYR A  72
 None
 0.77A 4r29D-3myoA:
undetectable		 4r29D-3myoA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nuz PUTATIVE ACETYL
XYLAN ESTERASE

(Bacteroides
fragilis) 		PF12715
(Abhydrolase_7) 		3 ARG A 307
GLU A 200
TYR A 224
 None
 0.98A 4r29D-3nuzA:
undetectable		 4r29D-3nuzA:
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.
3nwz BH2602 PROTEIN

(Bacillus
halodurans) 		PF03061
(4HBT) 		3 ARG A 127
GLU A 152
TYR A 125
 None
 0.94A 4r29D-3nwzA:
undetectable		 4r29D-3nwzA:
23.85
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.
3ol2 PLEXIN-B1

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI) 		3 ARG B  40
GLU B 464
TYR B 467
 None
 0.84A 4r29D-3ol2B:
undetectable		 4r29D-3ol2B:
15.84
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.
3ooi HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-36 AND H4
LYSINE-20 SPECIFIC

(Homo sapiens) 		PF00856
(SET) 		3 ARG A  88
GLU A  68
TYR A  90
 None
 0.96A 4r29D-3ooiA:
undetectable		 4r29D-3ooiA:
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.
3pwv MHC CLASS I ANTIGEN

(Bos taurus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 ARG A   5
GLU A 211
TYR A 101
 None
 0.67A 4r29D-3pwvA:
undetectable		 4r29D-3pwvA:
18.82
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.
3rze HISTAMINE H1
RECEPTOR, LYSOZYME
CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		3 ARG A1148
GLU A1011
TYR A1161
 None
 1.00A 4r29D-3rzeA:
undetectable		 4r29D-3rzeA:
19.91
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.
3vr1 PEPTIDE CHAIN
RELEASE FACTOR 3

(Desulfovibrio
vulgaris) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF16658
(RF3_C) 		3 ARG A  79
GLU A 265
TYR A  78
 None
 1.01A 4r29D-3vr1A:
undetectable		 4r29D-3vr1A:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4djh KAPPA-TYPE OPIOID
RECEPTOR, LYSOZYME

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		3 ARG A1148
GLU A1011
TYR A1161
 None
 0.87A 4r29D-4djhA:
undetectable		 4r29D-4djhA:
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.
4dyo ASPARTYL
AMINOPEPTIDASE

(Homo sapiens) 		PF02127
(Peptidase_M18) 		3 ARG A 380
GLU A 301
TYR A 381
 None
SD4  A 504 (-2.7A)
SD4  A 504 (-4.7A)
 1.00A 4r29D-4dyoA:
undetectable		 4r29D-4dyoA:
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.
4ffl PYLC

(Methanosarcina
barkeri) 		PF02655
(ATP-grasp_3) 		3 ARG A 243
GLU A 135
TYR A  98
 PO4  A 903 (-2.8A)
None
None
 0.94A 4r29D-4fflA:
undetectable		 4r29D-4fflA:
24.52
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.
4fir PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Pyrococcus
horikoshii) 		PF01680
(SOR_SNZ)
PF05690
(ThiG) 		3 ARG A 143
GLU A 109
TYR A 199
 None
 0.85A 4r29D-4firA:
undetectable		 4r29D-4firA:
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.
4hjh PHOSPHOMANNOMUTASE

(Brucella
melitensis) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 ARG A 445
GLU A 322
TYR A 447
 G6Q  A 544 (-4.0A)
G6Q  A 544 (-2.3A)
EDO  A 548 (-4.8A)
 0.97A 4r29D-4hjhA:
undetectable		 4r29D-4hjhA:
17.99
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.
4i3u ALDEHYDE
DEHYDROGENASE (NAD+)

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		3 ARG A 108
GLU A 442
TYR A 104
 POA  A 500 (-2.6A)
None
None
 0.98A 4r29D-4i3uA:
undetectable		 4r29D-4i3uA:
18.39
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.
4l5t INTERFERON-ACTIVABLE
PROTEIN 202

(Mus musculus) 		PF02760
(HIN) 		3 ARG A 376
GLU A 427
TYR A 375
 None
 1.02A 4r29D-4l5tA:
undetectable		 4r29D-4l5tA:
22.95
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.
4la2 DIMETHYLSULPHONIOPRO
PIONATE (DMSP) LYASE
DDDQ

(Ruegeria
lacuscaerulensis) 		PF16867
(DMSP_lyase) 		3 ARG A  75
GLU A  81
TYR A  90
 None
 0.78A 4r29D-4la2A:
undetectable		 4r29D-4la2A:
17.60
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.
4lx3 DNA POLYMERASE III,
ALPHA SUBUNIT
NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE

(Nostoc
punctiforme;
Nostoc
punctiforme) 		no annotation
no annotation 		3 ARG B   7
GLU A  86
TYR A  58
 None
 1.02A 4r29D-4lx3B:
undetectable		 4r29D-4lx3B:
10.05
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.
4miv N-SULPHOGLUCOSAMINE
SULPHOHYDROLASE

(Homo sapiens) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		3 ARG A 382
GLU A 355
TYR A 312
 None
 0.89A 4r29D-4mivA:
undetectable		 4r29D-4mivA:
15.48
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.
4n9n STEROL UPTAKE
CONTROL PROTEIN 2,
LYSOZYME

(Saccharomyces
cerevisiae;
Escherichia
virus T4) 		PF00959
(Phage_lysozyme)
PF11951
(Fungal_trans_2) 		3 ARG A1148
GLU A1011
TYR A1161
 None
 0.98A 4r29D-4n9nA:
undetectable		 4r29D-4n9nA:
18.59
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.
4nbg TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE

(Janthinobacterium
sp. J3) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		3 ARG A 172
GLU A 353
TYR A  18
 None
 0.96A 4r29D-4nbgA:
undetectable		 4r29D-4nbgA:
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.
4nwo MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
MOGA

(Shewanella
oneidensis) 		PF00994
(MoCF_biosynth) 		3 ARG A 173
GLU A 158
TYR A 152
 None
 0.94A 4r29D-4nwoA:
undetectable		 4r29D-4nwoA:
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.
4o3m BLOOM SYNDROME
PROTEIN

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF00570
(HRDC)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind) 		3 ARG A 859
GLU A 796
TYR A 974
 EDO  A1304 (-3.6A)
None
None
 0.94A 4r29D-4o3mA:
undetectable		 4r29D-4o3mA:
15.34
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.
4r20 CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2

(Danio rerio) 		PF00067
(p450) 		3 ARG A 246
GLU A 305
TYR A 208
 None
 0.88A 4r29D-4r20A:
undetectable		 4r29D-4r20A:
18.72
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.
4rgk UNCHARACTERIZED
PROTEIN

(Yersinia pestis) 		PF07350
(DUF1479) 		3 ARG A 286
GLU A 310
TYR A 282
 None
 0.92A 4r29D-4rgkA:
undetectable		 4r29D-4rgkA:
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.
4upi SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase) 		3 ARG A  16
GLU A 340
TYR A 294
 None
 0.71A 4r29D-4upiA:
undetectable		 4r29D-4upiA:
15.60
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.
4upl SULFATASE FAMILY
PROTEIN

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		3 ARG A  12
GLU A 338
TYR A 292
 None
 0.70A 4r29D-4uplA:
undetectable		 4r29D-4uplA:
17.34
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.
4wd4 HEME OXYGENASE 1

(Homo sapiens) 		PF01126
(Heme_oxygenase) 		3 ARG A  85
GLU A  81
TYR A 137
 None
 0.95A 4r29D-4wd4A:
undetectable		 4r29D-4wd4A:
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.
4xey TYROSINE-PROTEIN
KINASE ABL1

(Homo sapiens) 		no annotation 3 ARG B 381
GLU B 300
TYR B 412
 None
 0.99A 4r29D-4xeyB:
undetectable		 4r29D-4xeyB:
19.70
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.
4xvp BGFP-C

(synthetic
construct) 		PF02985
(HEAT)
PF03130
(HEAT_PBS)
PF13646
(HEAT_2) 		3 ARG D 140
GLU D 106
TYR D 161
 None
 1.02A 4r29D-4xvpD:
undetectable		 4r29D-4xvpD:
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.
4y1k OUTER MEMBRANE
PROTEIN OPRM

(Pseudomonas
aeruginosa) 		PF02321
(OEP) 		3 ARG A  78
GLU A 147
TYR A  77
 None
 0.96A 4r29D-4y1kA:
1.1		 4r29D-4y1kA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y93 NON-SPECIFIC
PROTEIN-TYROSINE
KINASE,NON-SPECIFIC
PROTEIN-TYROSINE
KINASE

(Bos taurus) 		PF00169
(PH)
PF00779
(BTK)
PF07714
(Pkinase_Tyr) 		3 ARG A 615
GLU A 640
TYR A 631
 None
 0.85A 4r29D-4y93A:
undetectable		 4r29D-4y93A:
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.
5bug PHOSPHATIDYLINOSITOL
3,4,5-TRISPHOSPHATE
3-PHOSPHATASE AND
DUAL-SPECIFICITY
PROTEIN PHOSPHATASE
PTEN

(Homo sapiens) 		PF00782
(DSPc)
PF10409
(PTEN_C2) 		3 ARG A 161
GLU A 157
TYR A  16
 None
 0.99A 4r29D-5bugA:
undetectable		 4r29D-5bugA:
21.74
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.
5crj TRANSCRIPTION
TERMINATION FACTOR
1, MITOCHONDRIAL

(Homo sapiens) 		PF02536
(mTERF) 		3 ARG O 350
GLU O 280
TYR O 317
 None
 0.95A 4r29D-5crjO:
undetectable		 4r29D-5crjO:
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.
5fr8 TONB-DEPENDENT
SIDEROPHORE RECEPTOR

(Acinetobacter
baumannii) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ARG A 108
GLU A  90
TYR A 472
 None
 1.00A 4r29D-5fr8A:
undetectable		 4r29D-5fr8A:
15.86
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.
5h3w FIBRONECTIN/FIBRINOG
EN BINDING PROTEIN

(Streptococcus
suis) 		PF05670
(DUF814)
PF05833
(FbpA) 		3 ARG A  45
GLU A  39
TYR A  97
 None
 1.01A 4r29D-5h3wA:
undetectable		 4r29D-5h3wA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hb4 NUP192,NUCLEOPORIN
NUP192

(Chaetomium
thermophilum) 		PF11894
(Nup192) 		3 ARG B 304
GLU B 355
TYR B 340
 None
 0.72A 4r29D-5hb4B:
undetectable		 4r29D-5hb4B:
8.90
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.
5hcc COMPLEMENT C5
COMPLEMENT C5

(Homo sapiens;
Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF01835
(A2M_N)
PF07703
(A2M_N_2) 		3 ARG A 766
GLU A1436
TYR B 222
 None
 0.91A 4r29D-5hccA:
undetectable		 4r29D-5hccA:
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.
5hdh TOLL-LIKE RECEPTOR 8

(Homo sapiens) 		PF13855
(LRR_8) 		3 ARG A 630
GLU A 578
TYR A 631
 None
 0.98A 4r29D-5hdhA:
undetectable		 4r29D-5hdhA:
14.95
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.
5hpk E3 UBIQUITIN-PROTEIN
LIGASE NEDD4-LIKE
UBIQUITIN VARIANT
NL.1

(Homo sapiens;
Homo sapiens) 		PF00632
(HECT)
PF00240
(ubiquitin) 		3 ARG B   6
GLU A 664
TYR B  68
 None
 0.63A 4r29D-5hpkB:
undetectable		 4r29D-5hpkB:
14.29
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.
5iz3 PREDICTED PROTEIN

(Physcomitrella
patens) 		PF00316
(FBPase) 		3 ARG B 374
GLU B 258
TYR B 283
 None
 0.96A 4r29D-5iz3B:
undetectable		 4r29D-5iz3B:
23.05
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.
5jir OOP FAMILY OMPA-OMPF
PORIN

(Treponema
pallidum) 		no annotation 3 ARG B 468
GLU B 214
TYR B 368
 None
 0.87A 4r29D-5jirB:
undetectable		 4r29D-5jirB:
18.23
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.
5jx5 GLUCANASE

(Orpinomyces sp.
Y102) 		PF01341
(Glyco_hydro_6) 		3 ARG A 185
GLU A 146
TYR A 186
 None
 0.90A 4r29D-5jx5A:
undetectable		 4r29D-5jx5A:
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.
5jzb 4,5:9,10-DISECO-3-HY
DROXY-5,9,17-TRIOXOA
NDROSTA-1(10),2-DIEN
E-4-OATE HYDROLASE

(Mycobacterium
tuberculosis) 		PF12697
(Abhydrolase_6) 		3 ARG A 228
GLU A 218
TYR A 227
 None
 0.88A 4r29D-5jzbA:
undetectable		 4r29D-5jzbA:
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.
5knn ALANINE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF01411
(tRNA-synt_2c) 		3 ARG A 326
GLU A 442
TYR A 322
 None
 0.94A 4r29D-5knnA:
undetectable		 4r29D-5knnA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lkd GLUTATHIONE
S-TRANSFERASE
OMEGA-LIKE 2

(Saccharomyces
cerevisiae) 		PF13409
(GST_N_2)
PF13410
(GST_C_2) 		3 ARG A  15
GLU A 238
TYR A 216
 GSH  A 401 (-4.0A)
None
None
 1.01A 4r29D-5lkdA:
undetectable		 4r29D-5lkdA:
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.
5lsu HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2

(Homo sapiens) 		PF00856
(SET) 		3 ARG A1060
GLU A1040
TYR A1062
 None
 0.89A 4r29D-5lsuA:
undetectable		 4r29D-5lsuA:
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.
5me4 PROBABLE PHOSPHITE
TRANSPORT
SYSTEM-BINDING
PROTEIN HTXB

(Pseudomonas
stutzeri) 		no annotation 3 ARG A 178
GLU A  28
TYR A  91
 HP4  A 301 ( 4.0A)
None
None
 0.96A 4r29D-5me4A:
undetectable		 4r29D-5me4A:
23.05
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.
5mzs FERRIC ENTEROBACTIN
RECEPTOR

(Pseudomonas
aeruginosa) 		no annotation 3 ARG A 100
GLU A  82
TYR A 469
 None
 0.99A 4r29D-5mzsA:
undetectable		 4r29D-5mzsA:
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.
5nny WIPB

(Legionella
pneumophila) 		no annotation 3 ARG A 173
GLU A 154
TYR A 288
 None
 0.92A 4r29D-5nnyA:
undetectable		 4r29D-5nnyA:
23.31
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.
5ov6 PORPHOBILINOGEN
DEAMINASE

(Bacillus
megaterium) 		PF01379
(Porphobil_deam)
PF03900
(Porphobil_deamC) 		3 ARG A 250
GLU A 187
TYR A 248
 None
 0.95A 4r29D-5ov6A:
undetectable		 4r29D-5ov6A:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tnu DNA-DEPENDENT ATPASE
XPBII

(Sulfurisphaera
tokodaii) 		no annotation 3 ARG A 205
GLU A 175
TYR A 213
 CL  A 511 ( 3.8A)
None
None
 0.94A 4r29D-5tnuA:
undetectable		 4r29D-5tnuA:
18.91
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.
5wan PYRIMIDINE
MONOOXYGENASE RUTA

(Escherichia
coli) 		PF00296
(Bac_luciferase) 		3 ARG A 141
GLU A 125
TYR A 137
 FMN  A 409 (-2.8A)
FMN  A 409 ( 4.8A)
None
 0.98A 4r29D-5wanA:
undetectable		 4r29D-5wanA:
18.95
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.
5xyi UNCHARACTERIZED
PROTEIN
40S RIBOSOMAL
PROTEIN S21

(Trichomonas
vaginalis;
Trichomonas
vaginalis) 		PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C)
PF01249
(Ribosomal_S21e) 		3 ARG V  15
GLU C 252
TYR C  72
 None
 0.97A 4r29D-5xyiV:
undetectable		 4r29D-5xyiV:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6az1 RIBOSOMAL PROTEIN
S8E
RIBOSOMAL PROTEIN
S17

(Leishmania
donovani;
Leishmania
donovani) 		no annotation
no annotation 		3 ARG K 187
GLU U  31
TYR K 211
 None
 0.95A 4r29D-6az1K:
undetectable		 4r29D-6az1K:
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.
6bba ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT,
MITOCHONDRIAL

(Homo sapiens) 		no annotation 3 ARG A 114
GLU A 152
TYR A 116
 None
 0.81A 4r29D-6bbaA:
undetectable		 4r29D-6bbaA:
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.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA

(Escherichia
coli) 		no annotation 3 ARG A  41
GLU A 201
TYR A  43
 None
 0.96A 4r29D-6bogA:
undetectable		 4r29D-6bogA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c90 EXOSOME RNA HELICASE
MTR4,EXOSOME RNA
HELICASE MTR4
ZINC FINGER CCHC
DOMAIN-CONTAINING
PROTEIN 8

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		3 ARG B 689
GLU A 201
TYR B 685
 None
 1.01A 4r29D-6c90B:
undetectable		 4r29D-6c90B:
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.
6f34 AMINO ACID
TRANSPORTER

(Geobacillus
kaustophilus) 		no annotation 3 ARG A 327
GLU A 245
TYR A 323
 None
None
OLC  A 503 (-3.7A)
 0.94A 4r29D-6f34A:
0.9		 4r29D-6f34A:
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.
6fd2 PUTATIVE APRAMYCIN
BIOSYNTHETIC
OXIDOREDUCTASE 4

(Streptoalloteichus
tenebrarius) 		no annotation 3 ARG B 319
GLU B 352
TYR B 213
 None
None
5AD  B 504 (-4.5A)
 0.73A 4r29D-6fd2B:
undetectable		 4r29D-6fd2B:
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.
6ffh METABOTROPIC
GLUTAMATE RECEPTOR
5,ENDOLYSIN

(Homo sapiens;
Escherichia
virus T4) 		no annotation 3 ARG A1148
GLU A1011
TYR A1161
 None
 0.90A 4r29D-6ffhA:
1.0		 4r29D-6ffhA:
undetectable