SIMILAR PATTERNS OF AMINO ACIDS FOR 4FIM_A_CELA711_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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		9 GLU A 431
GLY A 432
VAL A 591
PRO A 593
PRO A 655
GLU A 659
TYR A 660
GLY A 662
TYR A 665
 None
 0.73A 4fimA-1biyA:
55.1		 4fimA-1biyA:
91.06
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.
1e9y UREASE SUBUNIT ALPHA

(Helicobacter
pylori) 		PF00547
(Urease_gamma)
PF00699
(Urease_beta) 		5 GLU A  60
GLY A  61
VAL A  96
PRO A  99
GLU A  34
 None
 1.24A 4fimA-1e9yA:
undetectable		 4fimA-1e9yA:
20.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 GLU A 428
GLY A 430
PRO A 592
GLY A 660
TYR A 663
 None
 1.35A 4fimA-1h76A:
43.7		 4fimA-1h76A:
31.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 GLY A 430
PRO A 592
TYR A 658
GLY A 660
TYR A 663
 None
 0.42A 4fimA-1h76A:
43.7		 4fimA-1h76A:
31.60
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.
1hxn HEMOPEXIN

(Oryctolagus
cuniculus) 		PF00045
(Hemopexin) 		5 GLY A 312
VAL A 310
PRO A 314
GLU A 318
TYR A 299
 None
 1.27A 4fimA-1hxnA:
undetectable		 4fimA-1hxnA:
21.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		5 GLY A 432
PRO A 593
TYR A 660
GLY A 662
TYR A 665
 None
 0.63A 4fimA-1i6qA:
27.0		 4fimA-1i6qA:
55.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		5 PRO A 593
GLU A 659
TYR A 660
GLY A 662
TYR A 665
 None
 0.92A 4fimA-1i6qA:
27.0		 4fimA-1i6qA:
55.56
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.
1iom CITRATE SYNTHASE

(Thermus
thermophilus) 		PF00285
(Citrate_synt) 		5 GLY A 255
PRO A 309
GLU A 296
GLY A 299
TYR A 308
 None
 1.32A 4fimA-1iomA:
undetectable		 4fimA-1iomA:
22.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		5 GLU A 413
GLY A 424
PRO A 580
TYR A 647
TYR A 652
 None
 1.21A 4fimA-1jnfA:
50.2		 4fimA-1jnfA:
30.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jnf SEROTRANSFERRIN

(Oryctolagus
cuniculus) 		PF00405
(Transferrin) 		5 GLY A 424
PRO A 580
TYR A 647
GLY A 649
TYR A 652
 None
 0.49A 4fimA-1jnfA:
50.2		 4fimA-1jnfA:
30.61
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.
1mbq TRYPSIN

(Oncorhynchus
keta) 		PF00089
(Trypsin) 		5 GLY A  44
VAL A  31
PRO A 198
PRO A 124
GLU A 204
 None
 1.43A 4fimA-1mbqA:
undetectable		 4fimA-1mbqA:
21.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		6 GLU A 433
GLY A 434
PRO A 595
TYR A 662
GLY A 664
TYR A 667
 None
 0.58A 4fimA-1n76A:
53.0		 4fimA-1n76A:
68.89
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.
1nl3 PREPROTEIN
TRANSLOCASE SECA 1
SUBUNIT

(Mycobacterium
tuberculosis) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 GLY A 480
VAL A 433
PRO A 432
GLU A 546
GLY A 548
 None
 1.44A 4fimA-1nl3A:
undetectable		 4fimA-1nl3A:
15.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qjm LACTOFERRIN

(Equus caballus) 		PF00405
(Transferrin) 		6 GLU A 431
GLY A 432
PRO A 593
TYR A 660
GLY A 662
TYR A 665
 None
 0.66A 4fimA-1qjmA:
53.3		 4fimA-1qjmA:
45.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		5 GLU E 413
GLY E 424
PRO E 580
TYR E 647
TYR E 652
 None
 1.21A 4fimA-1suvE:
50.0		 4fimA-1suvE:
58.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1suv SEROTRANSFERRIN,
C-LOBE

(Homo sapiens) 		PF00405
(Transferrin) 		5 GLY E 424
PRO E 580
TYR E 647
GLY E 649
TYR E 652
 None
 0.49A 4fimA-1suvE:
50.0		 4fimA-1suvE:
58.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0l PROBABLE GTPASE ENGC

(Thermotoga
maritima) 		PF03193
(RsgA_GTPase)
PF16745
(RsgA_N) 		5 GLU A  22
GLY A   7
VAL A  49
GLU A  55
GLY A  59
 None
 1.44A 4fimA-1u0lA:
undetectable		 4fimA-1u0lA:
22.79
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.
1vho ENDOGLUCANASE

(Thermotoga
maritima) 		PF05343
(Peptidase_M42) 		5 GLY A 148
VAL A  73
GLU A  68
TYR A  21
GLY A  70
 GLY  A 148 ( 0.0A)
VAL  A  73 ( 0.6A)
GLU  A  68 ( 0.6A)
TYR  A  21 ( 1.3A)
GLY  A  70 ( 0.0A)
 1.24A 4fimA-1vhoA:
undetectable		 4fimA-1vhoA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wkc HB8 TT1367 PROTEIN

(Thermus
thermophilus) 		PF01812
(5-FTHF_cyc-lig) 		5 GLY A 140
VAL A 142
PRO A 109
TYR A 127
GLY A 121
 None
None
None
SO4  A 200 (-4.9A)
SO4  A 201 ( 3.1A)
 1.10A 4fimA-1wkcA:
undetectable		 4fimA-1wkcA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zcw AROMATIC
PRENYLTRANSFERASE

(Streptomyces
sp. CL190) 		PF11468
(PTase_Orf2) 		5 GLY A 205
PRO A 242
TYR A 283
GLY A 273
TYR A 272
 None
 1.29A 4fimA-1zcwA:
undetectable		 4fimA-1zcwA:
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.
2d5w PEPTIDE ABC
TRANSPORTER,
PEPTIDE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF00496
(SBP_bac_5) 		5 GLY A 151
GLU A  35
TYR A 572
GLY A 573
TYR A 568
 None
 1.32A 4fimA-2d5wA:
undetectable		 4fimA-2d5wA:
20.79
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.
2g36 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermotoga
maritima) 		PF00579
(tRNA-synt_1b) 		5 GLU A 143
GLY A 144
PRO A 146
TYR A  37
GLY A   6
 None
None
None
None
TRP  A 401 (-4.1A)
 1.14A 4fimA-2g36A:
undetectable		 4fimA-2g36A:
21.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hau SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 GLY A 425
PRO A 583
TYR A 650
GLY A 652
TYR A 655
 None
 0.71A 4fimA-2hauA:
26.7		 4fimA-2hauA:
31.30
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.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		5 GLU A 525
GLY A 521
VAL A 519
PRO A 469
GLY A 503
 None
 1.25A 4fimA-2hg4A:
2.2		 4fimA-2hg4A:
17.24
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.
2iuj LIPOXYGENASE L-5

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLY A 670
PRO A 228
TYR A 585
GLY A 221
TYR A 203
 None
 1.29A 4fimA-2iujA:
undetectable		 4fimA-2iujA:
16.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuk SEED LIPOXYGENASE

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLY A 682
PRO A 239
TYR A 597
GLY A 231
TYR A 215
 None
 1.34A 4fimA-2iukA:
undetectable		 4fimA-2iukA:
16.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oip CHAIN A, CRYSTAL
STRUCTURE OF DHFR

(Cryptosporidium
hominis) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		5 GLU A 352
GLY A 351
VAL A 363
PRO A 401
GLY A 343
 None
 1.06A 4fimA-2oipA:
undetectable		 4fimA-2oipA:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qa1 POLYKETIDE OXYGENASE
PGAE

(Streptomyces
sp. PGA64) 		PF01494
(FAD_binding_3) 		5 GLU A  65
GLY A  64
PRO A  61
GLU A 407
GLY A  58
 None
None
None
None
GOL  A 605 ( 4.4A)
 1.39A 4fimA-2qa1A:
undetectable		 4fimA-2qa1A:
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.
2qr4 PEPTIDASE M3B,
OLIGOENDOPEPTIDASE F

(Enterococcus
faecium) 		PF01432
(Peptidase_M3)
PF08439
(Peptidase_M3_N) 		5 GLU A 208
GLY A 204
VAL A 202
GLU A 507
GLY A 221
 None
 1.19A 4fimA-2qr4A:
undetectable		 4fimA-2qr4A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		5 VAL A 596
PRO A 594
PRO A 577
GLY A 585
TYR A  25
 None
 1.37A 4fimA-2x2iA:
undetectable		 4fimA-2x2iA:
15.42
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.
2zoo PROBABLE NITRITE
REDUCTASE

(Pseudoalteromonas
haloplanktis) 		PF00034
(Cytochrom_C)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3) 		5 GLY A 195
PRO A  58
TYR A 139
GLY A 219
TYR A 158
 None
 1.36A 4fimA-2zooA:
undetectable		 4fimA-2zooA:
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.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		5 GLU A 559
GLY A 179
GLU A 276
TYR A 277
GLY A 232
 None
 1.39A 4fimA-3cttA:
undetectable		 4fimA-3cttA:
16.55
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.
3ei8 LL-DIAMINOPIMELATE
AMINOTRANSFERASE

(Arabidopsis
thaliana) 		PF00155
(Aminotran_1_2) 		5 GLU A 326
GLY A 327
GLU A  68
GLY A 273
TYR A 271
 None
None
None
None
GOL  A 436 (-4.6A)
 1.48A 4fimA-3ei8A:
undetectable		 4fimA-3ei8A:
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.
3h39 TRNA NUCLEOTIDYL
TRANSFERASE-RELATED
PROTEIN

(Thermotoga
maritima) 		PF01743
(PolyA_pol)
PF12627
(PolyA_pol_RNAbd) 		5 GLU A  32
GLY A  30
VAL A  37
PRO A  36
GLY A  62
 None
 1.44A 4fimA-3h39A:
undetectable		 4fimA-3h39A:
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 4

(Thermus
thermophilus) 		PF00346
(Complex1_49kDa) 		5 GLU 4 341
GLY 4 340
PRO 4 338
GLU 4 102
GLY 4 106
 None
 1.07A 4fimA-3i9v4:
undetectable		 4fimA-3i9v4:
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.
3ldd CALCIUM-GATED
POTASSIUM CHANNEL
MTHK

(Methanothermobacter
thermautotrophicus) 		PF07885
(Ion_trans_2) 		5 GLY A  83
VAL A  30
PRO A  67
GLU A  42
GLY A  37
 None
 1.36A 4fimA-3lddA:
undetectable		 4fimA-3lddA:
12.05
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.
3lyl 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Francisella
tularensis) 		PF13561
(adh_short_C2) 		5 GLU A  20
GLY A  18
VAL A  10
GLU A  43
GLY A  58
 None
 1.43A 4fimA-3lylA:
undetectable		 4fimA-3lylA:
21.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		5 GLY A 426
PRO A 586
TYR A 652
GLY A 654
TYR A 657
 None
 0.49A 4fimA-3mc2A:
16.4		 4fimA-3mc2A:
33.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n7x CAPSID PROTEIN

(Decapod
penstyldensovirus
1) 		PF16530
(IHHNV_capsid) 		5 GLY A  43
PRO A 245
TYR A 311
GLY A 110
TYR A 109
 None
 1.45A 4fimA-3n7xA:
undetectable		 4fimA-3n7xA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		5 GLU A 999
GLY A 997
VAL A 996
PRO A 560
GLU A 583
 None
 1.42A 4fimA-3ob8A:
undetectable		 4fimA-3ob8A:
16.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q5w PROTEIN CUT8

(Schizosaccharomyces
pombe) 		PF08559
(Cut8) 		5 GLY A  95
PRO A  93
PRO A 151
GLY A 100
TYR A 102
 None
 1.31A 4fimA-3q5wA:
undetectable		 4fimA-3q5wA:
17.70
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.
3qdk RIBULOKINASE

(Bacillus
halodurans) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 GLU A 439
GLY A 288
GLU A 318
TYR A 325
GLY A 327
 None
 1.10A 4fimA-3qdkA:
undetectable		 4fimA-3qdkA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sfw DIHYDROPYRIMIDINASE

(Brevibacillus
agri) 		PF01979
(Amidohydro_1) 		5 GLY A 425
VAL A 400
PRO A 398
TYR A  49
GLY A  47
 None
None
ACT  A 463 ( 4.7A)
ACT  A 463 ( 3.7A)
ACT  A 463 (-3.8A)
 1.16A 4fimA-3sfwA:
undetectable		 4fimA-3sfwA:
23.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3skp SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 GLY A 425
PRO A 583
TYR A 650
GLY A 652
TYR A 655
 None
None
None
SO4  A 683 (-3.4A)
None
 0.82A 4fimA-3skpA:
25.4		 4fimA-3skpA:
59.82
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.
3v4p INTEGRIN ALPHA-4

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLU A 243
GLY A 246
PRO A 240
GLY A 219
TYR A 220
 None
 1.37A 4fimA-3v4pA:
undetectable		 4fimA-3v4pA:
20.40
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.
3v5r PROTEIN GAL3

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 VAL A 224
PRO A 234
GLU A 218
GLY A 216
TYR A 215
 None
 1.33A 4fimA-3v5rA:
undetectable		 4fimA-3v5rA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zbm COPPER-CONTAINING
NITRITE REDUCTASE

(Ralstonia
pickettii) 		PF07732
(Cu-oxidase_3)
PF13442
(Cytochrome_CBB3) 		5 GLY A 205
PRO A  68
TYR A 149
GLY A 229
TYR A 168
 None
 1.32A 4fimA-3zbmA:
undetectable		 4fimA-3zbmA:
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.
3zs6 PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Burkholderia
pseudomallei) 		PF00496
(SBP_bac_5) 		5 PRO A 367
PRO A 515
TYR A 514
GLY A 352
TYR A 351
 None
 1.23A 4fimA-3zs6A:
4.6		 4fimA-3zs6A:
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.
4a3r ENOLASE

(Bacillus
subtilis) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		5 GLU A 205
GLY A 206
PRO A 394
TYR A 403
GLY A 182
 None
 1.47A 4fimA-4a3rA:
undetectable		 4fimA-4a3rA:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ccl 50S RIBOSOMAL
PROTEIN L16 ARGININE
HYDROXYLASE

(Escherichia
coli) 		PF08007
(Cupin_4) 		5 GLY A 322
PRO A 205
GLU A 209
GLY A 213
TYR A 217
 None
 1.44A 4fimA-4cclA:
undetectable		 4fimA-4cclA:
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.
4d5g CYCLOHEXANE-1,2-DION
E HYDROLASE

(Azoarcus sp.
BH72) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A  73
VAL A  23
GLU A  89
GLY A  61
TYR A  62
 None
 1.44A 4fimA-4d5gA:
undetectable		 4fimA-4d5gA:
20.10
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.
4ds2 UBIQUITIN-CONJUGATIN
G ENZYME E2,
PUTATIVE

(Trypanosoma
cruzi) 		PF00179
(UQ_con) 		5 GLU A  98
GLY A  97
VAL A  95
GLY A 161
TYR A  91
 None
 1.27A 4fimA-4ds2A:
undetectable		 4fimA-4ds2A:
18.24
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		5 GLU A  25
GLY A  24
VAL A  46
PRO A  22
GLY A 109
 None
 1.44A 4fimA-4e4rA:
2.0		 4fimA-4e4rA:
23.06
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.
4fkz UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Bacillus
subtilis) 		PF02350
(Epimerase_2) 		5 GLY A 153
VAL A 171
PRO A 151
PRO A 292
GLY A 351
 None
 1.36A 4fimA-4fkzA:
undetectable		 4fimA-4fkzA:
23.75
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.
4fkz UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Bacillus
subtilis) 		PF02350
(Epimerase_2) 		5 GLY A 153
VAL A 171
PRO A 292
TYR A 350
GLY A 351
 None
 1.16A 4fimA-4fkzA:
undetectable		 4fimA-4fkzA:
23.75
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.
4hti RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE N2

(Homo sapiens) 		PF11548
(Receptor_IA-2) 		5 GLU A 525
GLY A 526
VAL A 549
GLU A 571
GLY A 512
 None
 1.35A 4fimA-4htiA:
undetectable		 4fimA-4htiA:
15.82
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.
4jc8 HOPS COMPONENT VPS33

(Chaetomium
thermophilum) 		PF00995
(Sec1) 		5 GLY A  81
PRO A 113
PRO A  42
GLU A 152
TYR A 140
 None
 1.30A 4fimA-4jc8A:
undetectable		 4fimA-4jc8A:
19.49
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.
4ko2 PERIPLASMIC [NIFESE]
HYDROGENASE SMALL
SUBUNIT

(Desulfomicrobium
baculatum) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 GLU S 221
GLY S 230
PRO S 240
GLU S 283
GLY S 236
 None
None
SF4  S 301 ( 4.5A)
None
None
 1.10A 4fimA-4ko2S:
undetectable		 4fimA-4ko2S:
23.35
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.
4kqn D-HYDANTOINASE

(Bacillus sp.
AR9) 		PF01979
(Amidohydro_1) 		5 GLY A 425
VAL A 400
PRO A 398
TYR A  49
GLY A  47
 GLY  A 425 ( 0.0A)
VAL  A 400 ( 0.6A)
PRO  A 398 ( 1.1A)
TYR  A  49 ( 1.3A)
GLY  A  47 ( 0.0A)
 1.26A 4fimA-4kqnA:
undetectable		 4fimA-4kqnA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ote LIPOPROTEIN

(Clostridioides
difficile) 		PF03180
(Lipoprotein_9) 		5 GLU A  45
GLY A  41
PRO A  39
GLU A 254
TYR A 107
 ZN  A 306 (-2.2A)
None
None
None
None
 1.23A 4fimA-4oteA:
5.8		 4fimA-4oteA:
23.88
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A  39
GLY A  38
VAL A 718
PRO A  36
GLY A 536
 None
 1.25A 4fimA-4q1vA:
undetectable		 4fimA-4q1vA:
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.
4qi4 CELLOBIOSE
DEHYDROGENASE

(Crassicarpon
hotsonii) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C) 		5 GLU A 454
GLY A 465
VAL A 224
PRO A 223
GLY A 461
 None
None
None
None
NAG  A 904 (-3.3A)
 1.31A 4fimA-4qi4A:
undetectable		 4fimA-4qi4A:
20.34
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.
4wb7 DNAJ HOMOLOG
SUBFAMILY B MEMBER
1,CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA

(Homo sapiens) 		PF00069
(Pkinase)
PF00226
(DnaJ) 		5 GLU A 182
GLY A 181
PRO A 179
GLU A 162
TYR A 177
 ATP  A 501 (-3.5A)
None
None
None
None
 1.30A 4fimA-4wb7A:
undetectable		 4fimA-4wb7A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a0z CHOLINE
TRIMETHYLAMINE LYASE

(Klebsiella
pneumoniae) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 GLU A 867
GLY A 778
PRO A 501
GLU A 613
GLY A 497
 None
 1.41A 4fimA-5a0zA:
undetectable		 4fimA-5a0zA:
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.
5dqq TWO PORE CALCIUM
CHANNEL PROTEIN 1

(Arabidopsis
thaliana) 		PF00520
(Ion_trans) 		5 GLY A 619
VAL A 621
PRO A 617
PRO A  97
GLY A 110
 None
 1.34A 4fimA-5dqqA:
undetectable		 4fimA-5dqqA:
17.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5evj ARSENITE
METHYLTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF13847
(Methyltransf_31) 		5 GLU A 281
GLY A 278
PRO A 277
GLU A 194
GLY A 192
 None
 1.13A 4fimA-5evjA:
undetectable		 4fimA-5evjA:
22.31
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.
5f0o COHESIN SUBUNIT
PDS5,
KLTH0D07062P,KLTH0D0
7062P,KLTH0D07062P,C
OHESIN SUBUNIT PDS5,
KLTH0D07062P,KLTH0D0
7062P,KLTH0D07062P,C
OHESIN SUBUNIT PDS5,
KLTH0D07062P,KLTH0D0
7062P,KLTH0D07062P,C
OHESIN SUBUNIT PDS5,
KLTH0D07062P,KLTH0D0
7062P

(Lachancea
thermotolerans) 		no annotation 5 GLU A 775
GLY A 776
PRO A 778
GLY A 873
TYR A 871
 None
 1.34A 4fimA-5f0oA:
undetectable		 4fimA-5f0oA:
16.26
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.
5fus PUTATIVE ENOYL COA
HYDRATASE

(Burkholderia
cenocepacia) 		PF00378
(ECH_1) 		5 GLU A 129
GLY A 130
VAL A 152
GLU A 138
GLY A 155
 None
None
None
DAO  A1285 ( 4.6A)
None
 1.19A 4fimA-5fusA:
undetectable		 4fimA-5fusA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h9x BETA-1,3-GLUCANASE

(Paenibacillus
barengoltzii) 		PF16483
(Glyco_hydro_64) 		5 GLU A 111
GLY A 113
VAL A 114
PRO A 191
GLY A 152
 None
 1.50A 4fimA-5h9xA:
undetectable		 4fimA-5h9xA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ipw OLIGOPEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN, PUTATIVE

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		5 GLY A  27
VAL A  76
PRO A  78
GLU A 658
GLY A  83
 None
 1.09A 4fimA-5ipwA:
3.3		 4fimA-5ipwA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lcx (-)-ISOPIPERITENONE
REDUCTASE

(Mentha x
piperita) 		PF00106
(adh_short) 		5 GLU A  20
GLY A  18
VAL A  10
GLU A  44
GLY A  42
 None
 1.20A 4fimA-5lcxA:
undetectable		 4fimA-5lcxA:
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.
5uc7 ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(environmental
samples) 		PF00202
(Aminotran_3) 		5 GLY A  48
PRO A 402
GLU A  33
TYR A  59
GLY A  34
 None
 1.37A 4fimA-5uc7A:
undetectable		 4fimA-5uc7A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xoy [LYSW]-LYSINE
HYDROLASE

(Thermus
thermophilus) 		PF01546
(Peptidase_M20) 		5 GLY A 320
VAL A  90
PRO A 319
TYR A 317
GLY A 147
 None
 1.21A 4fimA-5xoyA:
undetectable		 4fimA-5xoyA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cjq -

(-) 		no annotation 5 GLU A 271
VAL A 320
GLU A 258
TYR A 262
GLY A 323
 None
 1.44A 4fimA-6cjqA:
undetectable		 4fimA-6cjqA:
undetectable