SIMILAR PATTERNS OF AMINO ACIDS FOR 2NV4_A_SAMA201_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1crk CREATINE KINASE

(Gallus gallus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		5 GLN A  53
TYR A  46
GLY A  72
LEU A 137
SER A  47
 None
 1.06A 2nv4A-1crkA:
0.0		 2nv4A-1crkA:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dow ALPHA-CATENIN

(Mus musculus) 		PF01044
(Vinculin) 		5 ALA A  93
GLY A 101
LEU A 103
ASP A  96
LEU A 138
 None
 1.28A 2nv4A-1dowA:
undetectable		 2nv4A-1dowA:
17.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 GLN A 137
LYS A 143
GLY A 132
LEU A 133
ASP A 136
 None
 1.22A 2nv4A-1h76A:
0.0		 2nv4A-1h76A:
11.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hux ACTIVATOR OF
(R)-2-HYDROXYGLUTARY
L-COA DEHYDRATASE

(Acidaminococcus
fermentans) 		PF01869
(BcrAD_BadFG) 		5 GLN A 243
ALA A 219
ASP A   9
LYS A  16
GLY A  89
 ADP  A 506 (-3.7A)
None
None
ADP  A 506 (-2.5A)
None
 1.32A 2nv4A-1huxA:
0.0		 2nv4A-1huxA:
19.20
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.
1koe ENDOSTATIN

(Mus musculus) 		PF06482
(Endostatin) 		5 ALA A 280
PRO A 256
GLY A 223
LEU A 217
SER A 285
 None
 1.35A 2nv4A-1koeA:
undetectable		 2nv4A-1koeA:
20.11
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.
1o66 3-METHYL-2-OXOBUTANO
ATE
HYDROXYMETHYLTRANSFE
RASE

(Neisseria
meningitidis) 		PF02548
(Pantoate_transf) 		5 GLN A 239
ALA A  34
GLY A  73
ASP A  32
LEU A  30
 None
 1.34A 2nv4A-1o66A:
0.0		 2nv4A-1o66A:
21.51
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ALA A 938
GLY A 931
ASP A 936
LEU A 926
SER A 923
 None
 1.35A 2nv4A-1ofeA:
undetectable		 2nv4A-1ofeA:
7.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rrh SEED LIPOXYGENASE-3

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLY A 720
LEU A 722
ASP A 766
LEU A 773
SER A 774
 None
 1.31A 2nv4A-1rrhA:
0.0		 2nv4A-1rrhA:
10.50
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.
1yga HYPOTHETICAL 37.9
KDA PROTEIN IN
BIO3-HXT17
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim) 		5 ALA A  23
GLY A  45
ASP A  34
LEU A  32
SER A 177
 None
 1.32A 2nv4A-1ygaA:
0.0		 2nv4A-1ygaA:
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		5 ALA A 364
GLN A  59
GLY A  45
LEU A  46
SER A 356
 None
 1.36A 2nv4A-1yniA:
0.0		 2nv4A-1yniA:
13.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zj9 PROBABLE
FERREDOXIN-DEPENDENT
NITRITE REDUCTASE
NIRA

(Mycobacterium
tuberculosis) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 ALA A 343
ASP A 217
GLY A 103
LEU A 173
SER A 171
 None
 1.32A 2nv4A-1zj9A:
undetectable		 2nv4A-1zj9A:
13.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cfm THERMOSTABLE DNA
LIGASE

(Pyrococcus
furiosus) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 GLN A  11
ALA A   7
GLY A  91
LEU A  90
LEU A 149
 None
 1.04A 2nv4A-2cfmA:
undetectable		 2nv4A-2cfmA:
14.59
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.
2e9y CARBAMATE KINASE

(Aeropyrum
pernix) 		PF00696
(AA_kinase) 		5 ALA A  15
GLN A  28
GLY A  90
LEU A  91
LEU A  11
 None
 1.32A 2nv4A-2e9yA:
undetectable		 2nv4A-2e9yA:
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.
2hjr MALATE DEHYDROGENASE

(Cryptosporidium
parvum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ALA A 254
LYS A  15
GLY A  34
LEU A  31
LEU A 258
 None
 1.32A 2nv4A-2hjrA:
undetectable		 2nv4A-2hjrA:
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.
2hl9 UBIQUITIN-LIKE-SPECI
FIC PROTEASE 1

(Saccharomyces
cerevisiae) 		PF02902
(Peptidase_C48) 		5 ASP A 531
PRO A 507
GLY A 581
LEU A 449
LEU A 510
 None
None
OCS  A 580 ( 2.4A)
None
None
 1.34A 2nv4A-2hl9A:
undetectable		 2nv4A-2hl9A:
20.09
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.
2iel HYPOTHETICAL PROTEIN
TT0030

(Thermus
thermophilus) 		no annotation 5 GLN A 122
ALA A 123
LEU A 107
LEU A  85
SER A  83
 None
 1.24A 2nv4A-2ielA:
undetectable		 2nv4A-2ielA:
20.25
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.
2iuj LIPOXYGENASE L-5

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 GLY A 715
LEU A 717
ASP A 761
LEU A 768
SER A 769
 None
 1.35A 2nv4A-2iujA:
undetectable		 2nv4A-2iujA:
10.32
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.
2ivf ETHYLBENZENE
DEHYDROGENASE
ALPHA-SUBUNIT

(Aromatoleum
aromaticum) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 ALA A 595
ASP A 712
GLY A 542
LEU A 543
SER A 183
 None
 1.28A 2nv4A-2ivfA:
undetectable		 2nv4A-2ivfA:
10.37
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.
2j0a BETA-1,3-N-ACETYLGLU
COSAMINYLTRANSFERASE
MANIC FRINGE

(Mus musculus) 		PF02434
(Fringe) 		5 GLN A 271
ALA A 151
GLY A 200
LEU A 252
SER A 250
 None
 1.11A 2nv4A-2j0aA:
undetectable		 2nv4A-2j0aA:
20.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2nv4 UPF0066 PROTEIN
AF_0241

(Archaeoglobus
fulgidus) 		PF01980
(UPF0066) 		12 GLN A  16
ALA A  19
GLN A  22
TYR A  55
ASP A  58
LYS A  59
PRO A  84
GLY A  91
LEU A  92
ASP A 111
LEU A 113
SER A 116
 None
SAM  A 201 (-3.6A)
SAM  A 201 (-2.9A)
SAM  A 201 (-4.8A)
SAM  A 201 (-3.5A)
None
SAM  A 201 ( 4.3A)
SAM  A 201 (-3.5A)
SAM  A 201 (-4.4A)
SAM  A 201 (-3.3A)
SAM  A 201 (-3.6A)
SAM  A 201 (-2.7A)
 0.02A 2nv4A-2nv4A:
27.8		 2nv4A-2nv4A:
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.
2oce HYPOTHETICAL PROTEIN
PA5201

(Pseudomonas
aeruginosa) 		PF00575
(S1)
PF09371
(Tex_N)
PF12836
(HHH_3)
PF16921
(Tex_YqgF) 		5 ALA A 447
GLY A 341
LEU A 338
ASP A 335
LEU A 444
 None
 1.26A 2nv4A-2oceA:
undetectable		 2nv4A-2oceA:
10.13
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.
2or0 HYDROXYLASE

(Rhodococcus
jostii) 		PF08028
(Acyl-CoA_dh_2) 		5 ALA A  91
GLN A  94
GLY A 200
ASP A  92
LEU A 204
 None
 1.34A 2nv4A-2or0A:
undetectable		 2nv4A-2or0A:
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.
2pp3 L-TALARATE/GALACTARA
TE DEHYDRATASE

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLN A 265
ALA A 268
ASP A 259
GLY A 292
LEU A 291
 None
 1.25A 2nv4A-2pp3A:
undetectable		 2nv4A-2pp3A:
19.52
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.
2qnr SEPTIN-2

(Homo sapiens) 		PF00735
(Septin) 		5 ALA A 166
PRO A 103
GLY A  44
LEU A  48
ASP A 164
 None
 1.13A 2nv4A-2qnrA:
undetectable		 2nv4A-2qnrA:
19.27
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.
2qnr SEPTIN-2

(Homo sapiens) 		PF00735
(Septin) 		5 ALA A 166
TYR A 151
PRO A 103
GLY A  44
ASP A 164
 None
 1.15A 2nv4A-2qnrA:
undetectable		 2nv4A-2qnrA:
19.27
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.
2qvb HALOALKANE
DEHALOGENASE 3

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		5 GLN A  36
GLN A 121
TYR A  83
GLY A  84
ASP A 117
 None
 1.09A 2nv4A-2qvbA:
undetectable		 2nv4A-2qvbA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r80 HEMOGLOBIN SUBUNIT
ALPHA-A

(Columba livia) 		PF00042
(Globin) 		5 ALA A  65
GLY A 133
LEU A 130
LEU A  83
SER A  84
 HEM  A 150 ( 4.0A)
HEM  A 150 ( 4.4A)
None
HEM  A 150 (-4.3A)
None
 1.22A 2nv4A-2r80A:
undetectable		 2nv4A-2r80A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rch CYTOCHROME P450 74A

(Arabidopsis
thaliana) 		PF00067
(p450) 		5 ALA A  81
TYR A 417
PRO A 421
GLY A 418
LEU A 116
 None
 0.98A 2nv4A-2rchA:
undetectable		 2nv4A-2rchA:
15.15
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		5 GLN A  50
ALA A  56
GLY A  15
LEU A  17
LEU A 328
 None
None
FAD  A 403 (-3.3A)
None
None
 1.24A 2nv4A-2rgjA:
undetectable		 2nv4A-2rgjA:
17.16
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.
2v1u CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG

(Aeropyrum
pernix) 		PF09079
(Cdc6_C)
PF13191
(AAA_16) 		5 ALA A 247
PRO A 212
GLY A  68
ASP A 253
LEU A 218
 None
None
ADP  A1400 (-2.2A)
None
None
 1.27A 2nv4A-2v1uA:
undetectable		 2nv4A-2v1uA:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wym L-ASCORBATE-6-PHOSPH
ATE LACTONASE ULAG

(Escherichia
coli) 		PF13483
(Lactamase_B_3) 		5 ASP A 226
GLY A  47
LEU A  43
ASP A 283
SER A 248
 MN  A1341 (-3.6A)
None
None
None
None
 1.22A 2nv4A-2wymA:
undetectable		 2nv4A-2wymA:
17.91
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.
2xts SULFITE
DEHYDROGENASE
CYTOCHROME

(Paracoccus
pantotrophus;
Paracoccus
pantotrophus) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer)
PF13442
(Cytochrome_CBB3) 		5 ALA B  44
ASP A 274
LYS A 275
GLY A 133
LEU B  46
 None
 1.24A 2nv4A-2xtsB:
undetectable		 2nv4A-2xtsB:
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.
2yet GH61 ISOZYME A

(Thermoascus
aurantiacus) 		PF03443
(Glyco_hydro_61) 		5 GLN A  50
ASP A 105
PRO A  52
GLY A 196
LEU A 199
 None
 1.30A 2nv4A-2yetA:
undetectable		 2nv4A-2yetA:
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.
2z8z LIPASE

(Pseudomonas sp.
MIS38) 		PF00353
(HemolysinCabind) 		5 ALA A 293
TYR A  40
LEU A 314
LEU A 345
SER A 346
 None
 1.35A 2nv4A-2z8zA:
undetectable		 2nv4A-2z8zA:
12.35
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.
3ckb SUSD

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB) 		5 ALA A 213
TYR A 258
PRO A 285
LEU A 225
ASP A 219
 None
 1.13A 2nv4A-3ckbA:
undetectable		 2nv4A-3ckbA:
14.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 ALA A 118
ASP A 206
GLY A 201
LEU A 198
LEU A 147
 None
 1.34A 2nv4A-3d1jA:
undetectable		 2nv4A-3d1jA:
14.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA
PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens;
Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4)
PF00104
(Hormone_recep)
PF00105
(zf-C4) 		5 GLN D 410
ALA A 416
GLN A 411
ASP D 396
LEU A 420
 None
 1.03A 2nv4A-3dzuD:
undetectable		 2nv4A-3dzuD:
17.06
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.
3e13 PUTATIVE IRON-UPTAKE
ABC TRANSPORT
SYSTEM,PERIPLASMIC
IRON-BINDING PROTEIN

(Campylobacter
jejuni) 		PF13343
(SBP_bac_6) 		5 GLN X 286
TYR X 274
LYS X 289
GLY X 205
LEU X 207
 None
 1.22A 2nv4A-3e13X:
undetectable		 2nv4A-3e13X:
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.
3ewn THIJ/PFPI FAMILY
PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF01965
(DJ-1_PfpI) 		5 GLN A 229
ALA A 228
ASP A 210
GLY A  71
LEU A 213
 None
 1.21A 2nv4A-3ewnA:
undetectable		 2nv4A-3ewnA:
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.
3f75 CATHEPSIN L PROTEASE

(Toxoplasma
gondii) 		PF00112
(Peptidase_C1) 		5 ALA A  79
ASP A 120
GLY A 117
LEU A 116
SER A 220
 None
 1.12A 2nv4A-3f75A:
undetectable		 2nv4A-3f75A:
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.
3fmc PUTATIVE
SUCCINYLGLUTAMATE
DESUCCINYLASE /
ASPARTOACYLASE

(Shewanella
amazonensis) 		PF04952
(AstE_AspA) 		5 GLN A 191
ALA A 189
PRO A 276
GLY A 259
LEU A 261
 None
 1.35A 2nv4A-3fmcA:
undetectable		 2nv4A-3fmcA:
16.03
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.
3hhr HUMAN GROWTH HORMONE
RECEPTOR (HGHBP)

(Homo sapiens) 		PF00041
(fn3)
PF09067
(EpoR_lig-bind) 		5 GLN B 216
ALA B 163
GLY B 223
ASP B 132
LEU B 172
 None
 1.18A 2nv4A-3hhrB:
undetectable		 2nv4A-3hhrB:
18.96
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.
3k8k ALPHA-AMYLASE, SUSG

(Bacteroides
thetaiotaomicron) 		PF00128
(Alpha-amylase) 		5 ALA A 516
LYS A 505
GLY A 536
LEU A 535
SER A 495
 None
 1.31A 2nv4A-3k8kA:
undetectable		 2nv4A-3k8kA:
12.11
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.
3mj8 STIMULATORY HAMSTER
ANTIBODY HL4E10 FAB
LIGHT CHAIN

(Cricetulus
migratorius) 		no annotation 5 ASP L  85
LYS L 103
PRO L   7
GLY L  99
LEU L   4
 None
 1.35A 2nv4A-3mj8L:
undetectable		 2nv4A-3mj8L:
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.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		5 ALA A 244
PRO A 321
GLY A 299
LEU A 234
SER A 281
 None
 1.17A 2nv4A-3of7A:
undetectable		 2nv4A-3of7A:
15.58
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.
3p30 1281 FAB LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP L  85
LYS L 103
PRO L   7
GLY L  99
LEU L   4
 None
 1.36A 2nv4A-3p30L:
undetectable		 2nv4A-3p30L:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qp9 TYPE I POLYKETIDE
SYNTHASE PIKAII

(Streptomyces
venezuelae) 		PF08659
(KR) 		5 ALA A 356
PRO A 149
GLY A 406
LEU A 401
SER A 417
 None
 1.33A 2nv4A-3qp9A:
undetectable		 2nv4A-3qp9A:
11.92
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.
3sfw DIHYDROPYRIMIDINASE

(Brevibacillus
agri) 		PF01979
(Amidohydro_1) 		5 GLN A 381
ASP A 119
GLY A  53
LEU A  51
SER A 432
 None
 1.30A 2nv4A-3sfwA:
undetectable		 2nv4A-3sfwA:
15.47
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.
3u43 COLICIN-E2

(Escherichia
coli) 		no annotation 5 ALA B  26
PRO B  35
GLY B  19
ASP B  25
LEU B  23
 None
 1.27A 2nv4A-3u43B:
undetectable		 2nv4A-3u43B:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zhb R-IMINE REDUCTASE

(Streptomyces
kanamyceticus) 		PF03446
(NAD_binding_2) 		5 ALA A 188
ASP A 179
GLY A 134
LEU A 109
LEU A 185
 None
 1.20A 2nv4A-3zhbA:
undetectable		 2nv4A-3zhbA:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zhb R-IMINE REDUCTASE

(Streptomyces
kanamyceticus) 		PF03446
(NAD_binding_2) 		5 ALA A 188
GLY A 134
LEU A 109
ASP A 187
LEU A 185
 None
 1.13A 2nv4A-3zhbA:
undetectable		 2nv4A-3zhbA:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zl4 A17 ANTIBODY FAB
FRAGMENT LAMBDA
LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP L  86
LYS L 105
PRO L   7
GLY L 101
LEU L   4
 None
 1.34A 2nv4A-3zl4L:
undetectable		 2nv4A-3zl4L:
21.48
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.
4bwf UBIQUITIN-CONJUGATIN
G ENZYME E2-21 KDA

(Saccharomyces
cerevisiae) 		PF00179
(UQ_con) 		5 ALA A 136
LYS A 120
PRO A  93
LEU A  81
LEU A 116
 EDO  A1181 ( 4.6A)
None
None
None
None
 1.21A 2nv4A-4bwfA:
undetectable		 2nv4A-4bwfA:
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		5 GLN A 513
GLY B 382
LEU A 600
ASP A 560
SER B 385
 None
None
NAG  B3371 (-3.2A)
None
NAG  B3452 ( 4.9A)
 1.33A 2nv4A-4cakA:
undetectable		 2nv4A-4cakA:
10.28
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.
4eba MRNA
3'-END-PROCESSING
PROTEIN RNA14

(Kluyveromyces
lactis) 		PF05843
(Suf) 		5 GLN A 168
GLN A 316
ASP A 120
LEU A 125
SER A 126
 None
 1.33A 2nv4A-4ebaA:
undetectable		 2nv4A-4ebaA:
12.42
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.
4ex6 ALNB

(Streptomyces
sp. CM020) 		PF13419
(HAD_2) 		5 ALA A 180
GLY A  18
ASP A 179
LEU A 203
SER A 198
 None
MG  A 301 ( 4.3A)
MG  A 301 ( 4.5A)
None
None
 1.32A 2nv4A-4ex6A:
undetectable		 2nv4A-4ex6A:
21.76
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.
4h1s 5'-NUCLEOTIDASE

(Homo sapiens) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		6 GLN A 279
TYR A 176
LYS A 179
GLY A 219
LEU A 218
ASP A 226
 None
 1.34A 2nv4A-4h1sA:
undetectable		 2nv4A-4h1sA:
14.72
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.
4hne PHOSPHATIDYLINOSITOL
4-KINASE TYPE
2-ALPHA

(Homo sapiens) 		PF00454
(PI3_PI4_kinase) 		5 ALA A 350
GLN A 426
ASP A 182
PRO A 356
LEU A 184
 ALA  A 350 ( 0.0A)
GLN  A 426 ( 0.6A)
ASP  A 182 ( 0.6A)
PRO  A 356 ( 1.1A)
LEU  A 184 ( 0.6A)
 1.32A 2nv4A-4hneA:
undetectable		 2nv4A-4hneA:
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.
4hpf POTASSIUM CHANNEL
SUBFAMILY U MEMBER 1

(Homo sapiens) 		PF03493
(BK_channel_a) 		5 GLN A 448
ASP A 426
GLY A 730
LEU A 731
SER A 422
 None
 1.33A 2nv4A-4hpfA:
undetectable		 2nv4A-4hpfA:
13.23
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.
4ilk STARVATION SENSING
PROTEIN RSPB

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 245
GLY A 259
ASP A 234
LEU A 242
SER A 265
 None
 1.32A 2nv4A-4ilkA:
undetectable		 2nv4A-4ilkA:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k1x NADPH:FERREDOXIN
REDUCTASE

(Rhodobacter
capsulatus) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 PRO A 108
GLY A  47
LEU A 112
LEU A  77
SER A  70
 None
 1.26A 2nv4A-4k1xA:
3.8		 2nv4A-4k1xA:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lsb LYASE/MUTASE

(Burkholderia
cenocepacia) 		PF13714
(PEP_mutase) 		5 ALA A 119
ASP A  87
PRO A 188
LEU A 185
ASP A 118
 None
MG  A 501 ( 4.1A)
None
None
None
 1.19A 2nv4A-4lsbA:
undetectable		 2nv4A-4lsbA:
17.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mgg MUCONATE LACTONIZING
ENZYME

(Labrenzia
aggregata) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 108
PRO A 354
GLY A 351
LEU A 347
ASP A 111
 None
 1.31A 2nv4A-4mggA:
undetectable		 2nv4A-4mggA:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n0i GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF01425
(Amidase) 		5 TYR A 171
ASP A 187
PRO A 214
GLY A 172
LEU A 217
 None
 1.25A 2nv4A-4n0iA:
undetectable		 2nv4A-4n0iA:
15.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLN A  15
ASP A 159
GLY A 272
LEU A 268
SER A 143
 None
 1.21A 2nv4A-4nhdA:
undetectable		 2nv4A-4nhdA:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o5a LACI FAMILY
TRANSCRIPTION
REGULATOR

(Bifidobacterium
animalis) 		PF13377
(Peripla_BP_3) 		5 ALA A 173
GLY A 201
LEU A 200
ASP A 172
SER A 160
 None
 1.16A 2nv4A-4o5aA:
undetectable		 2nv4A-4o5aA:
18.55
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		5 ALA A 387
GLN A 385
ASP A 417
GLY A 410
ASP A 379
 None
None
ZN  A 801 ( 4.7A)
None
None
 1.27A 2nv4A-4ojzA:
undetectable		 2nv4A-4ojzA:
10.18
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.
4oqr CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 LYS A  11
GLY A 311
LEU A 312
LEU A  33
SER A  37
 None
 1.29A 2nv4A-4oqrA:
undetectable		 2nv4A-4oqrA:
15.50
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.
4pk1 CHIMERA PROTEIN OF
OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTORS BAMA AND
BAMB

(Escherichia
coli) 		PF07244
(POTRA)
PF13360
(PQQ_2) 		5 ALA A1075
GLY A1057
ASP A1076
LEU A1063
SER A1061
 None
 1.34A 2nv4A-4pk1A:
undetectable		 2nv4A-4pk1A:
13.21
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.
4pyr PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Chromobacterium
violaceum) 		PF04348
(LppC) 		5 GLN A 267
GLN A 293
ASP A 214
LEU A 263
SER A 217
 None
 1.13A 2nv4A-4pyrA:
undetectable		 2nv4A-4pyrA:
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.
4qci ANTI-PDGF-BB
ANTIBODY - LIGHT
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP A  84
LYS A 102
PRO A   7
GLY A  98
LEU A   4
 None
 1.28A 2nv4A-4qciA:
undetectable		 2nv4A-4qciA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ras OXIDOREDUCTASE,
NAD-BINDING/IRON-SUL
FUR CLUSTER-BINDING
PROTEIN

(Nitratireductor
pacificus) 		PF12838
(Fer4_7)
PF13486
(Dehalogenase) 		5 GLN A 122
ALA A 120
TYR A  88
GLY A  14
LEU A  13
 None
 1.28A 2nv4A-4rasA:
undetectable		 2nv4A-4rasA:
12.36
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.
4u28 PHOSPHORIBOSYL
ISOMERASE A

(Streptomyces
sviceus) 		PF00977
(His_biosynth) 		5 ALA A 211
GLY A 202
LEU A 178
ASP A 208
SER A 223
 None
PO4  A 301 (-3.7A)
None
None
None
 1.27A 2nv4A-4u28A:
undetectable		 2nv4A-4u28A:
19.34
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.
4ut7 BROADLY NEUTRALIZING
HUMAN ANTIBODY EDE2
A11

(Homo sapiens) 		PF07686
(V-set) 		5 ASP L  85
LYS L 103
PRO L   7
GLY L  99
LEU L   4
 None
 1.32A 2nv4A-4ut7L:
undetectable		 2nv4A-4ut7L:
18.90
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.
4v20 CELLOBIOHYDROLASE

(Aspergillus
fumigatus) 		PF00840
(Glyco_hydro_7) 		5 GLN A 193
ASP A 241
GLY A 207
ASP A 179
SER A 248
 None
 1.31A 2nv4A-4v20A:
undetectable		 2nv4A-4v20A:
13.41
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.
4x28 ACYL-COA
DEHYDROGENASE
ACYL-COA
DEHYDROGENASE

(Mycobacterium
tuberculosis;
Mycobacterium
tuberculosis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
no annotation 		5 GLN D 360
ALA D 315
GLY A 346
LEU A 345
LEU D 354
 None
 1.06A 2nv4A-4x28D:
undetectable		 2nv4A-4x28D:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xeu TRANSKETOLASE

(Pseudomonas
aeruginosa) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLN A 361
ALA A 363
TYR A 430
GLY A 376
LEU A 375
 None
 1.27A 2nv4A-4xeuA:
undetectable		 2nv4A-4xeuA:
11.57
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.
4xky DIHYDRODIPICOLINATE
SYNTHASE

(Bacteroides
thetaiotaomicron) 		PF00701
(DHDPS) 		5 GLN A 243
ALA A 294
LYS A 240
GLY A 211
LEU A 298
 None
 0.97A 2nv4A-4xkyA:
undetectable		 2nv4A-4xkyA:
18.81
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.
4xsr ALR3699 PROTEIN

(Nostoc sp. PCC
7120) 		no annotation 5 GLN B  99
ALA B 101
GLY B  13
LEU B  17
ASP B   7
 None
None
UPG  B 403 ( 4.0A)
UPG  B 403 (-4.6A)
None
 1.14A 2nv4A-4xsrB:
undetectable		 2nv4A-4xsrB:
18.73
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.
4zg8 ENDOGLUCANASE

(Perinereis
brevicirris) 		PF00759
(Glyco_hydro_9) 		5 ALA A 144
LYS A 110
GLY A  69
LEU A  70
LEU A  55
 None
 1.28A 2nv4A-4zg8A:
undetectable		 2nv4A-4zg8A:
16.39
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.
4zv7 LIPASE B

(Moesziomyces
antarcticus) 		no annotation 5 ALA A  86
PRO A  38
GLY A 108
LEU A 109
LEU A  35
 None
 1.18A 2nv4A-4zv7A:
undetectable		 2nv4A-4zv7A:
17.30
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.
5c2b 3B4 LIGHT CHAIN

(Homo sapiens) 		PF07686
(V-set) 		5 ASP L  87
LYS L 106
PRO L   7
GLY L 102
LEU L   4
 None
 1.22A 2nv4A-5c2bL:
undetectable		 2nv4A-5c2bL:
21.48
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.
5c2c FORM II RUBISCO

(Gallionella) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 ALA A 392
GLY A 186
LEU A 185
LEU A 410
SER A 409
 None
 1.26A 2nv4A-5c2cA:
undetectable		 2nv4A-5c2cA:
13.57
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.
5dmn HOMOCYSTEINE
S-METHYLTRANSFERASE

(Escherichia
coli) 		PF02574
(S-methyl_trans) 		5 ALA A 278
PRO A 254
GLY A  21
ASP A 302
LEU A 306
 None
 1.30A 2nv4A-5dmnA:
undetectable		 2nv4A-5dmnA:
22.34
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.
5ew5 COLICIN-E9

(Escherichia
coli) 		PF03515
(Cloacin) 		5 ALA A 474
PRO A 483
GLY A 467
ASP A 473
LEU A 471
 None
 1.09A 2nv4A-5ew5A:
undetectable		 2nv4A-5ew5A:
13.82
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.
5f7u CYCLOALTERNAN-FORMIN
G ENZYME

(Listeria
monocytogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF16990
(CBM_35) 		5 GLN A1064
ALA A1010
GLY A 807
LEU A 791
ASP A1009
 None
 1.22A 2nv4A-5f7uA:
undetectable		 2nv4A-5f7uA:
8.11
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.
5jmd HEPARINASE III
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07940
(Hepar_II_III)
PF16889
(Hepar_II_III_N) 		5 GLN A  86
PRO A 137
GLY A  92
LEU A  93
SER A 106
 None
 1.18A 2nv4A-5jmdA:
undetectable		 2nv4A-5jmdA:
11.60
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.
5jz7 MEDI578 SCFV, LIGHT
CHAIN

(Homo sapiens) 		PF07686
(V-set) 		5 ASP D  85
LYS D 103
PRO D   7
GLY D  99
LEU D   4
 None
 1.29A 2nv4A-5jz7D:
undetectable		 2nv4A-5jz7D:
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.
5mu5 UNCHARACTERIZED
PROTEIN

(Magnetospirillum
magneticum) 		no annotation 5 TYR A 216
GLY A 128
LEU A 129
LEU A 220
SER A 218
 None
 1.35A 2nv4A-5mu5A:
undetectable		 2nv4A-5mu5A:
12.16
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.
5n2k BRIAKINUMAB FAB
LIGHT CHAIN

(Homo sapiens) 		no annotation 5 ASP G  86
LYS G 107
PRO G   7
GLY G 103
LEU G   4
 None
 1.31A 2nv4A-5n2kG:
undetectable		 2nv4A-5n2kG:
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.
5o2x GLYCOSIDE HYDROLASE
FAMILY 61

(Trichoderma
reesei) 		PF03443
(Glyco_hydro_61) 		5 GLN A  50
ASP A 105
PRO A  52
GLY A 195
LEU A 198
 None
None
MAN  A 304 (-4.0A)
None
None
 1.34A 2nv4A-5o2xA:
undetectable		 2nv4A-5o2xA:
16.53
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.
5ocm NAD_GLY3P_DH,
NAD-DEPENDENT
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Streptosporangium
roseum) 		no annotation 5 ASP A 162
GLY A 117
LEU A  92
ASP A 170
LEU A 168
 None
 1.35A 2nv4A-5ocmA:
undetectable		 2nv4A-5ocmA:
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.
5ukh UNCHARACTERIZED
PROTEIN

(Streptococcus
intermedius) 		no annotation 5 GLN A 336
ALA A 332
LEU A 272
LEU A 319
SER A 317
 None
 1.32A 2nv4A-5ukhA:
undetectable		 2nv4A-5ukhA:
18.67
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.
5umh CATECHOL
1,2-DIOXYGENASE

(Burkholderia
multivorans) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 ALA A  95
GLN A 300
PRO A 292
GLY A 100
ASP A  92
 None
 1.14A 2nv4A-5umhA:
undetectable		 2nv4A-5umhA:
19.37
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.
5vrc BIFUNCTIONAL
COENZYME PQQ
SYNTHESIS PROTEIN
C/D

(Methylobacterium
extorquens) 		no annotation 5 ALA A  56
GLN A 252
PRO A 247
GLY A 244
LEU A 236
 None
 1.17A 2nv4A-5vrcA:
undetectable		 2nv4A-5vrcA:
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.
5zvs VP2
PUTATIVE CORE
PROTEIN NTPASE/VP5

(Aquareovirus C;
Aquareovirus C) 		no annotation
no annotation 		5 GLN 2 655
TYR 2 601
ASP 4 524
LEU 2 657
SER 4 574
 None
 1.32A 2nv4A-5zvs2:
undetectable		 2nv4A-5zvs2:
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.
6a2f -

(-) 		no annotation 5 ALA A 334
GLY A 216
LEU A 230
ASP A 331
LEU A 344
 None
 1.32A 2nv4A-6a2fA:
2.6		 2nv4A-6a2fA:
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.
6aqh LYSINE--TRNA LIGASE

(Mycolicibacterium
thermoresistibile) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 ALA A 297
GLN A 181
PRO A 307
GLY A 485
LEU A 316
 None
 1.30A 2nv4A-6aqhA:
undetectable		 2nv4A-6aqhA:
13.58
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.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 5 ALA A  76
GLN A 287
PRO A 283
LEU A 331
LEU A 341
 None
None
RFH  A 502 ( 4.2A)
None
RFH  A 502 (-4.4A)
 1.24A 2nv4A-6c7sA:
undetectable		 2nv4A-6c7sA:
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.
6gnf -

(-) 		no annotation 5 ALA A 345
ASP A 105
ASP A 346
LEU A 339
SER A 369
 None
 1.35A 2nv4A-6gnfA:
undetectable		 2nv4A-6gnfA:
undetectable