SIMILAR PATTERNS OF AMINO ACIDS FOR 4GC9_A_ACTA402_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.
1ctm CYTOCHROME F

(Brassica rapa) 		PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N) 		3 LYS A 109
TYR A 105
ARG A 106
 None
 1.22A 4gc9A-1ctmA:
undetectable		 4gc9A-1ctmA:
23.99
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.
1d5f E6AP HECT CATALYTIC
DOMAIN, E3 LIGASE

(Homo sapiens) 		PF00632
(HECT) 		3 LYS A 497
TYR A 499
ARG A 501
 None
 0.81A 4gc9A-1d5fA:
undetectable		 4gc9A-1d5fA:
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.
1eyv N-UTILIZING
SUBSTANCE PROTEIN B
HOMOLOG

(Mycobacterium
tuberculosis) 		PF01029
(NusB) 		3 LYS A   9
TYR A  54
ARG A  14
 None
None
PO4  A 350 (-3.0A)
 1.44A 4gc9A-1eyvA:
undetectable		 4gc9A-1eyvA:
19.71
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.
1fon PROCARBOXYPEPTIDASE
A-S6

(Bos taurus) 		PF00089
(Trypsin) 		3 LYS A  20
TYR A  18
ARG A  49
 None
 1.15A 4gc9A-1fonA:
undetectable		 4gc9A-1fonA:
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.
1h3m 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Escherichia
coli) 		PF01128
(IspD) 		3 LYS A  25
TYR A  29
ARG A  64
 None
 1.23A 4gc9A-1h3mA:
2.9		 4gc9A-1h3mA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h79 ANAEROBIC
RIBONUCLEOTIDE-TRIPH
OSPHATE REDUCTASE
LARGE CHAIN

(Escherichia
virus T4) 		PF13597
(NRDD) 		3 LYS A 103
TYR A 139
ARG A 142
 TTP  A1586 (-4.6A)
None
None
 1.15A 4gc9A-1h79A:
undetectable		 4gc9A-1h79A:
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.
1ipg BEM1 PROTEIN

(Saccharomyces
cerevisiae) 		PF00564
(PB1) 		3 LYS A  35
TYR A  34
ARG A  38
 None
 1.45A 4gc9A-1ipgA:
undetectable		 4gc9A-1ipgA:
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.
1kph CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 1

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		3 LYS A  85
TYR A  86
ARG A  81
 None
 1.42A 4gc9A-1kphA:
9.7		 4gc9A-1kphA:
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.
1sgf NERVE GROWTH FACTOR

(Mus musculus) 		PF00089
(Trypsin) 		3 LYS A  39
TYR A  40
ARG A  35
 None
 1.25A 4gc9A-1sgfA:
undetectable		 4gc9A-1sgfA:
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.
1tfs TOXIN FS2

(Dendroaspis
polylepis) 		no annotation 3 LYS A  60
TYR A   4
ARG A  37
 None
 1.38A 4gc9A-1tfsA:
undetectable		 4gc9A-1tfsA:
9.25
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.
1tt4 PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF04107
(GCS2) 		3 LYS A 281
TYR A 280
ARG A 284
 None
 1.42A 4gc9A-1tt4A:
undetectable		 4gc9A-1tt4A:
22.88
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.
1u2v ACTIN-RELATED
PROTEIN 3

(Bos taurus) 		PF00022
(Actin) 		3 LYS A 254
TYR A 231
ARG A 275
 None
 1.26A 4gc9A-1u2vA:
undetectable		 4gc9A-1u2vA:
25.05
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.
1v4g GLUTAMATE--CYSTEINE
LIGASE

(Escherichia
coli) 		PF04262
(Glu_cys_ligase) 		3 LYS A 128
TYR A 131
ARG A 132
 None
 1.22A 4gc9A-1v4gA:
undetectable		 4gc9A-1v4gA:
21.24
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.
1xhb POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 1

(Mus musculus) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		3 LYS A 364
TYR A 393
ARG A 368
 None
 1.14A 4gc9A-1xhbA:
undetectable		 4gc9A-1xhbA:
20.41
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.
1zd1 SULFOTRANSFERASE 4A1

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		3 LYS A  13
TYR A  19
ARG A  26
 None
 1.38A 4gc9A-1zd1A:
undetectable		 4gc9A-1zd1A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a2b BACTERIOCIN CURVACIN
A

(Lactobacillus
curvatus) 		PF01721
(Bacteriocin_II) 		3 LYS A   1
TYR A   4
ARG A   2
 None
 1.38A 4gc9A-2a2bA:
undetectable		 4gc9A-2a2bA:
7.85
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.
2b6c HYPOTHETICAL PROTEIN
EF3068

(Enterococcus
faecalis) 		PF08713
(DNA_alkylation) 		3 LYS A 210
TYR A 211
ARG A 181
 None
 1.43A 4gc9A-2b6cA:
undetectable		 4gc9A-2b6cA:
22.60
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.
2bll PROTEIN YFBG

(Escherichia
coli) 		PF01370
(Epimerase) 		3 LYS A 316
TYR A 344
ARG A 317
 None
 1.41A 4gc9A-2bllA:
3.4		 4gc9A-2bllA:
22.60
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.
2bug SERINE/THREONINE
PROTEIN PHOSPHATASE
5

(Homo sapiens) 		PF00515
(TPR_1)
PF13181
(TPR_8) 		3 LYS A  97
TYR A 100
ARG A 101
 None
 0.95A 4gc9A-2bugA:
undetectable		 4gc9A-2bugA:
17.72
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.
2ctp DNAJ HOMOLOG
SUBFAMILY B MEMBER
12

(Homo sapiens) 		PF00226
(DnaJ) 		3 LYS A  25
TYR A  28
ARG A  29
 None
 1.24A 4gc9A-2ctpA:
undetectable		 4gc9A-2ctpA:
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.
2d9y PLECKSTRIN HOMOLOGY
DOMAIN-CONTAINING
PROTEIN FAMILY A
MEMBER 6

(Homo sapiens) 		PF00169
(PH) 		3 LYS A  44
TYR A  42
ARG A  31
 None
 1.35A 4gc9A-2d9yA:
undetectable		 4gc9A-2d9yA:
16.28
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.
2dht 409AA LONG
HYPOTHETICAL
NADP-DEPENDENT
ISOCITRATE
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00180
(Iso_dh) 		3 LYS A 198
TYR A 197
ARG A 201
 None
 1.42A 4gc9A-2dhtA:
undetectable		 4gc9A-2dhtA:
23.50
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.
2ehq 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Thermus
thermophilus) 		PF00171
(Aldedh) 		3 LYS A 474
TYR A 470
ARG A 473
 None
 1.08A 4gc9A-2ehqA:
2.5		 4gc9A-2ehqA:
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.
2gsk VITAMIN B12
TRANSPORTER BTUB

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 LYS A 244
TYR A 275
ARG A 283
 None
 1.10A 4gc9A-2gskA:
undetectable		 4gc9A-2gskA:
20.23
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.
2k2o MYOFERLIN

(Homo sapiens) 		no annotation 3 LYS A 991
TYR A 982
ARG A1021
 None
 1.28A 4gc9A-2k2oA:
undetectable		 4gc9A-2k2oA:
17.28
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.
2l6e CAPSID PROTEIN P24

(Human
immunodeficiency
virus 1) 		PF00607
(Gag_p24) 		3 LYS A 170
TYR A 169
ARG A 173
 None
 1.37A 4gc9A-2l6eA:
undetectable		 4gc9A-2l6eA:
14.20
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.
2lqt COILED-COIL-HELIX-CO
ILED-COIL-HELIX
DOMAIN-CONTAINING
PROTEIN 7

(Homo sapiens) 		no annotation 3 LYS A  45
TYR A  44
ARG A  48
 None
 1.36A 4gc9A-2lqtA:
undetectable		 4gc9A-2lqtA:
13.75
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.
2lxn GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG] SUBUNIT A

(Methanocaldococcus
jannaschii) 		PF00117
(GATase) 		3 LYS A  20
TYR A  21
ARG A  17
 None
 1.14A 4gc9A-2lxnA:
undetectable		 4gc9A-2lxnA:
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.
2m3l PROTEIN E6

(Alphapapillomavirus
5) 		PF00518
(E6) 		3 LYS A 123
TYR A  84
ARG A 124
 None
 1.40A 4gc9A-2m3lA:
undetectable		 4gc9A-2m3lA:
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.
2n3o POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 1

(Homo sapiens) 		no annotation 3 LYS A  65
TYR A 127
ARG A  64
 G  B   9 ( 2.7A)
G  B   9 ( 4.9A)
G  B   9 ( 3.1A)
 0.88A 4gc9A-2n3oA:
undetectable		 4gc9A-2n3oA:
16.67
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.
2osr NUCLEOLAR PROTEIN 3

(Saccharomyces
cerevisiae) 		PF00076
(RRM_1) 		3 LYS A  84
TYR A  86
ARG A  85
 None
 1.39A 4gc9A-2osrA:
undetectable		 4gc9A-2osrA:
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.
2qby CELL DIVISION
CONTROL PROTEIN 6
HOMOLOG 3

(Sulfolobus
solfataricus) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		3 LYS B  51
TYR B  48
ARG B  47
 None
 1.06A 4gc9A-2qbyB:
undetectable		 4gc9A-2qbyB:
23.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qie MOLYBDOPTERIN-CONVER
TING FACTOR SUBUNIT
2

(Staphylococcus
aureus) 		PF02391
(MoaE) 		3 LYS A 102
TYR A 105
ARG A 106
 None
 1.22A 4gc9A-2qieA:
undetectable		 4gc9A-2qieA:
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.
2qqk NEUROPILIN-2

(Homo sapiens) 		PF00431
(CUB)
PF00754
(F5_F8_type_C) 		3 LYS A 517
TYR A 555
ARG A 518
 None
 1.38A 4gc9A-2qqkA:
undetectable		 4gc9A-2qqkA:
20.93
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.
2vki 3-PHOPSHOINOSITIDE
DEPENDENT PROTEIN
KINASE 1

(Homo sapiens) 		PF14593
(PH_3) 		3 LYS A 495
TYR A 486
ARG A 474
 SO4  A1550 ( 4.7A)
None
SO4  A1550 (-2.9A)
 1.23A 4gc9A-2vkiA:
undetectable		 4gc9A-2vkiA:
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.
2wjr PROBABLE
N-ACETYLNEURAMINIC
ACID OUTER MEMBRANE
CHANNEL PROTEIN NANC

(Escherichia
coli) 		PF06178
(KdgM) 		3 LYS A  91
TYR A  89
ARG A 105
 EPE  A1217 (-2.7A)
None
None
 1.01A 4gc9A-2wjrA:
undetectable		 4gc9A-2wjrA:
18.37
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.
2y4t DNAJ HOMOLOG
SUBFAMILY C MEMBER 3

(Homo sapiens) 		PF00226
(DnaJ)
PF09976
(TPR_21)
PF13181
(TPR_8) 		3 LYS A 397
TYR A 396
ARG A 403
 None
 1.35A 4gc9A-2y4tA:
undetectable		 4gc9A-2y4tA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b6n 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Plasmodium
vivax) 		PF02542
(YgbB) 		3 LYS A   4
TYR A 117
ARG A 184
 None
 1.19A 4gc9A-3b6nA:
undetectable		 4gc9A-3b6nA:
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.
3cyv UROPORPHYRINOGEN
DECARBOXYLASE

(Shigella
flexneri) 		PF01208
(URO-D) 		3 LYS A  37
TYR A  36
ARG A  40
 None
 1.41A 4gc9A-3cyvA:
undetectable		 4gc9A-3cyvA:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d6j PUTATIVE HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bacteroides
fragilis) 		PF13419
(HAD_2) 		3 LYS A 111
TYR A 112
ARG A 115
 None
 1.19A 4gc9A-3d6jA:
2.2		 4gc9A-3d6jA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e7w D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 LYS A 477
TYR A 439
ARG A 476
 None
 1.32A 4gc9A-3e7wA:
undetectable		 4gc9A-3e7wA:
19.65
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.
3eh2 PROTEIN TRANSPORT
PROTEIN SEC24C

(Homo sapiens) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 LYS A 102
TYR A 104
ARG A 429
 None
 1.35A 4gc9A-3eh2A:
undetectable		 4gc9A-3eh2A:
18.28
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.
3icf SERINE/THREONINE-PRO
TEIN PHOSPHATASE T

(Saccharomyces
cerevisiae) 		PF00149
(Metallophos)
PF08321
(PPP5) 		3 LYS A 429
TYR A 355
ARG A 428
 None
 1.39A 4gc9A-3icfA:
undetectable		 4gc9A-3icfA:
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.
3j7y ML51

(Homo sapiens) 		PF00466
(Ribosomal_L10) 		3 LYS i 119
TYR i 118
ARG i 123
 U  A2013 ( 3.0A)
A  A1731 ( 3.5A)
A  A1722 ( 2.8A)
 1.27A 4gc9A-3j7yi:
undetectable		 4gc9A-3j7yi:
17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k5p D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Brucella
abortus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 LYS A   8
TYR A  33
ARG A   9
 None
 1.26A 4gc9A-3k5pA:
3.4		 4gc9A-3k5pA:
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.
3kd7 CTPR390

(unidentified) 		PF13414
(TPR_11)
PF13432
(TPR_16) 		3 LYS A  78
TYR A  81
ARG A  82
 None
 1.45A 4gc9A-3kd7A:
undetectable		 4gc9A-3kd7A:
15.41
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.
3kvs C-PHYCOCYANIN BETA
CHAIN

(Galdieria
sulphuraria) 		PF00502
(Phycobilisome) 		3 LYS B  73
TYR B  74
ARG B  78
 MEN  B  72 (-3.3A)
None
None
 1.35A 4gc9A-3kvsB:
undetectable		 4gc9A-3kvsB:
19.94
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.
3l8d METHYLTRANSFERASE

(Bacillus
thuringiensis) 		PF08241
(Methyltransf_11) 		3 LYS A  70
TYR A  69
ARG A  73
 None
 1.46A 4gc9A-3l8dA:
8.9		 4gc9A-3l8dA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lm2 PUTATIVE KINASE

(Agrobacterium
fabrum) 		PF00480
(ROK) 		3 LYS A 146
TYR A 142
ARG A 143
 None
 1.29A 4gc9A-3lm2A:
undetectable		 4gc9A-3lm2A:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mpn TRANSPORTER

(Aquifex
aeolicus) 		PF00209
(SNF) 		3 LYS A   5
TYR A 268
ARG A   5
 None
 1.15A 4gc9A-3mpnA:
undetectable		 4gc9A-3mpnA:
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.
3nzt GLUTAMATE--CYSTEINE
LIGASE

(Francisella
tularensis) 		PF04262
(Glu_cys_ligase) 		3 LYS A 115
TYR A 118
ARG A 119
 SO4  A 505 (-2.5A)
None
SO4  A 505 (-2.8A)
 1.27A 4gc9A-3nztA:
undetectable		 4gc9A-3nztA:
20.75
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.
3pqs TRANSFERRIN-BINDING
PROTEIN

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		3 LYS A 523
TYR A 397
ARG A 524
 None
None
GOL  A 541 ( 3.9A)
 1.35A 4gc9A-3pqsA:
undetectable		 4gc9A-3pqsA:
20.66
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.
3r9p ACKA

(Mycobacterium
avium) 		PF00871
(Acetate_kinase) 		3 LYS A 299
TYR A 300
ARG A 296
 EDO  A 389 ( 4.0A)
EDO  A 389 ( 4.0A)
None
 1.42A 4gc9A-3r9pA:
undetectable		 4gc9A-3r9pA:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s3r CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)

(Schistosoma
mansoni) 		PF00112
(Peptidase_C1) 		3 LYS A 192
TYR A 194
ARG A  96
 None
 1.42A 4gc9A-3s3rA:
undetectable		 4gc9A-3s3rA:
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.
3slc ACETATE KINASE

(Salmonella
enterica) 		PF00871
(Acetate_kinase) 		3 LYS A 312
TYR A 313
ARG A 309
 None
 1.35A 4gc9A-3slcA:
undetectable		 4gc9A-3slcA:
22.83
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.
3u44 ATP-DEPENDENT
HELICASE/DEOXYRIBONU
CLEASE SUBUNIT B

(Bacillus
subtilis) 		PF12705
(PDDEXK_1) 		3 LYS B 439
TYR B 400
ARG B 399
 None
 1.11A 4gc9A-3u44B:
undetectable		 4gc9A-3u44B:
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.
3ug7 ARSENICAL
PUMP-DRIVING ATPASE

(Methanocaldococcus
jannaschii) 		PF02374
(ArsA_ATPase) 		3 LYS A  27
TYR A  28
ARG A 237
 None
 1.14A 4gc9A-3ug7A:
undetectable		 4gc9A-3ug7A:
23.19
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.
3ve9 OROTIDINE-5'-PHOSPHA
TE DECARBOXYLASE

(Metallosphaera
sedula) 		PF00215
(OMPdecase) 		3 LYS A   1
TYR A 176
ARG A   3
 None
 1.32A 4gc9A-3ve9A:
undetectable		 4gc9A-3ve9A:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vvc CAPSULAR
POLYSACCHARIDE
SYNTHESIS ENZYME
CAP8E

(Staphylococcus
aureus) 		PF02719
(Polysacc_synt_2)
PF08485
(Polysacc_syn_2C) 		3 LYS A  55
TYR A  57
ARG A  33
 None
 1.21A 4gc9A-3vvcA:
5.1		 4gc9A-3vvcA:
22.71
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.
3vza SPC24 PROTEIN

(Gallus gallus) 		no annotation 3 LYS D 143
TYR D 142
ARG D 146
 None
 1.30A 4gc9A-3vzaD:
undetectable		 4gc9A-3vzaD:
12.71
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.
3w4r CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18) 		3 LYS A 164
TYR A 167
ARG A 124
 None
 1.00A 4gc9A-3w4rA:
undetectable		 4gc9A-3w4rA:
19.79
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.
3wl1 CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18) 		3 LYS A 164
TYR A 167
ARG A 124
 None
 1.01A 4gc9A-3wl1A:
undetectable		 4gc9A-3wl1A:
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.
3wo8 BETA-N-ACETYLGLUCOSA
MINIDASE

(Thermotoga
maritima) 		PF00933
(Glyco_hydro_3) 		3 LYS A 442
TYR A 426
ARG A 441
 None
 1.35A 4gc9A-3wo8A:
undetectable		 4gc9A-3wo8A:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E

(Caulobacter sp.
K31) 		PF01532
(Glyco_hydro_47) 		3 LYS A 394
TYR A 403
ARG A 398
 None
 1.45A 4gc9A-4ayrA:
undetectable		 4gc9A-4ayrA:
24.49
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.
4d0p COP9 SIGNALOSOME
COMPLEX SUBUNIT 4

(Homo sapiens) 		PF01399
(PCI) 		3 LYS A 188
TYR A 191
ARG A 207
 None
 1.31A 4gc9A-4d0pA:
undetectable		 4gc9A-4d0pA:
24.30
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.
4dq8 ACETATE KINASE

(Mycobacterium
marinum) 		PF00871
(Acetate_kinase) 		3 LYS A 299
TYR A 300
ARG A 296
 None
 1.41A 4gc9A-4dq8A:
undetectable		 4gc9A-4dq8A:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4elx 1,4-DIHYDROXY-2-NAPH
THOYL-COA SYNTHASE

(Escherichia
coli) 		PF00378
(ECH_1) 		3 LYS A  80
TYR A 129
ARG A  45
 None
 1.39A 4gc9A-4elxA:
undetectable		 4gc9A-4elxA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f0t C-PHYCOCYANIN BETA
CHAIN

(Synechocystis
sp. PCC 6803) 		PF00502
(Phycobilisome) 		3 LYS B  75
TYR B  76
ARG B  80
 MEN  B  72 (-3.4A)
None
MEN  B  72 (-4.5A)
 1.46A 4gc9A-4f0tB:
undetectable		 4gc9A-4f0tB:
17.39
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.
4f0u ALLOPHYCOCYANIN,
BETA SUBUNIT

(Synechococcus
elongatus) 		PF00502
(Phycobilisome) 		3 LYS B  75
TYR B  76
ARG B  80
 MEN  B  72 (-3.2A)
None
None
 1.34A 4gc9A-4f0uB:
undetectable		 4gc9A-4f0uB:
16.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		3 LYS A 258
TYR A 259
ARG A 262
 ACT  A 401 (-4.1A)
ACT  A 401 (-3.6A)
ACT  A 401 (-3.9A)
 0.24A 4gc9A-4gc5A:
47.1		 4gc9A-4gc5A:
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.
4hfs UNCHARACTERIZED
PROTEIN YNCM

(Bacillus
subtilis) 		PF15493
(YrpD) 		3 LYS A 191
TYR A  60
ARG A  58
 SO4  A 301 (-2.6A)
SO4  A 301 (-4.4A)
SO4  A 301 (-4.1A)
 1.38A 4gc9A-4hfsA:
undetectable		 4gc9A-4hfsA:
17.93
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.
4ijn ACETATE KINASE

(Mycolicibacterium
smegmatis) 		PF00871
(Acetate_kinase) 		3 LYS A 291
TYR A 292
ARG A 288
 None
 1.38A 4gc9A-4ijnA:
undetectable		 4gc9A-4ijnA:
23.45
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.
4itm TETRAACYLDISACCHARID
E 4'-KINASE

(Aquifex
aeolicus) 		PF02606
(LpxK) 		3 LYS A 308
TYR A 311
ARG A 312
 None
 1.27A 4gc9A-4itmA:
undetectable		 4gc9A-4itmA:
24.16
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.
4jip GTN REDUCTASE

(Agrobacterium
tumefaciens) 		PF00724
(Oxidored_FMN) 		3 LYS A 290
TYR A 293
ARG A 294
 None
 1.15A 4gc9A-4jipA:
undetectable		 4gc9A-4jipA:
23.15
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.
4le1 TRANSCRIPTIONAL
REGULATORY PROTEIN
DESR

(Bacillus
subtilis) 		PF00072
(Response_reg) 		3 LYS A  97
TYR A 123
ARG A 121
 None
 1.45A 4gc9A-4le1A:
undetectable		 4gc9A-4le1A:
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.
4r7z CELL DIVISION
CONTROL PROTEIN 21

(Pyrococcus
furiosus) 		PF00493
(MCM) 		3 LYS A 753
TYR A 755
ARG A 347
 None
 1.24A 4gc9A-4r7zA:
undetectable		 4gc9A-4r7zA:
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.
4xa8 D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE
NAD-BINDING

(Xanthobacter
autotrophicus) 		PF02826
(2-Hacid_dh_C) 		3 LYS A  71
TYR A  53
ARG A  52
 None
 1.42A 4gc9A-4xa8A:
4.7		 4gc9A-4xa8A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y93 NON-SPECIFIC
PROTEIN-TYROSINE
KINASE,NON-SPECIFIC
PROTEIN-TYROSINE
KINASE

(Bos taurus) 		PF00169
(PH)
PF00779
(BTK)
PF07714
(Pkinase_Tyr) 		3 LYS A  53
TYR A  39
ARG A  28
 None
 1.43A 4gc9A-4y93A:
undetectable		 4gc9A-4y93A:
23.16
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.
4yds FLAGELLA-RELATED
PROTEIN H

(Sulfolobus
acidocaldarius) 		PF06745
(ATPase) 		3 LYS A  82
TYR A  77
ARG A  80
 None
 1.18A 4gc9A-4ydsA:
undetectable		 4gc9A-4ydsA:
23.51
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.
4ye4 LIGHT CHAIN OF HJ16

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 LYS L  24
TYR L  77
ARG L  76
 None
 1.36A 4gc9A-4ye4L:
undetectable		 4gc9A-4ye4L:
20.23
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.
4yra L-THREONINE
3-DEHYDROGENASE,
MITOCHONDRIAL

(Mus musculus) 		PF01370
(Epimerase) 		3 LYS A 111
TYR A 110
ARG A 114
 None
 1.20A 4gc9A-4yraA:
2.8		 4gc9A-4yraA:
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.
4zoq INTRACELLULAR SERINE
PROTEASE

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		3 LYS I 128
TYR I 434
ARG I 432
 None
 1.34A 4gc9A-4zoqI:
undetectable		 4gc9A-4zoqI:
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.
5bn7 MALTODEXTRIN
GLUCOSIDASE

(Escherichia
coli) 		PF00128
(Alpha-amylase) 		3 LYS A 131
TYR A 175
ARG A 132
 None
 1.03A 4gc9A-5bn7A:
undetectable		 4gc9A-5bn7A:
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.
5elp NRPS/PKS PROTEIN

(Bacillus
amyloliquefaciens) 		no annotation 3 LYS C 583
TYR C 485
ARG C 584
 None
 1.15A 4gc9A-5elpC:
undetectable		 4gc9A-5elpC:
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.
5fmg PROTEASOME SUBUNIT
ALPHA, PUTATIVE

(Plasmodium
falciparum) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		3 LYS A   9
TYR A  23
ARG A  11
 None
 1.44A 4gc9A-5fmgA:
undetectable		 4gc9A-5fmgA:
19.65
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.
5gw4 T-COMPLEX PROTEIN 1
SUBUNIT GAMMA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		3 LYS g 375
TYR g 203
ARG g 330
 None
 1.20A 4gc9A-5gw4g:
undetectable		 4gc9A-5gw4g:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hj5 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Vibrio cholerae) 		PF01182
(Glucosamine_iso) 		3 LYS A 124
TYR A 121
ARG A 120
 None
None
GOL  A 304 ( 4.5A)
 0.92A 4gc9A-5hj5A:
2.7		 4gc9A-5hj5A:
20.23
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.
5inw PUTATIVE
ANGIOTENSINOGEN

(Lampetra
fluviatilis) 		PF00079
(Serpin) 		3 LYS A  76
TYR A 152
ARG A 155
 None
 1.01A 4gc9A-5inwA:
undetectable		 4gc9A-5inwA:
22.75
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.
5j9s PROTEIN ENL

(Homo sapiens) 		PF03366
(YEATS) 		3 LYS A 134
TYR A 133
ARG A 137
 None
 1.39A 4gc9A-5j9sA:
undetectable		 4gc9A-5j9sA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mlc 50S RIBOSOMAL
PROTEIN L21,
CHLOROPLASTIC

(Spinacia
oleracea) 		PF00829
(Ribosomal_L21p) 		3 LYS T 199
TYR T 206
ARG T 208
 C  A1020 ( 3.3A)
G  A1208 ( 4.0A)
C  A 826 ( 3.8A)
 1.37A 4gc9A-5mlcT:
undetectable		 4gc9A-5mlcT:
23.80
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.
5mu5 UNCHARACTERIZED
PROTEIN

(Magnetospirillum
magneticum) 		no annotation 3 LYS A  95
TYR A  99
ARG A  96
 None
 1.27A 4gc9A-5mu5A:
undetectable		 4gc9A-5mu5A:
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.
5o60 50S RIBOSOMAL
PROTEIN L24

(Mycolicibacterium
smegmatis) 		PF00467
(KOW)
PF17136
(ribosomal_L24) 		3 LYS V  32
TYR V  27
ARG V  30
 A  A 566 ( 4.0A)
None
A  A 567 ( 4.9A)
 0.67A 4gc9A-5o60V:
undetectable		 4gc9A-5o60V:
14.12
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.
5ool 39S RIBOSOMAL
PROTEIN L37,
MITOCHONDRIAL

(Homo sapiens) 		PF07147
(PDCD9) 		3 LYS 5 172
TYR 5 176
ARG 5 173
 U  A2392 ( 4.1A)
None
A  A2395 ( 3.0A)
 1.27A 4gc9A-5ool5:
undetectable		 4gc9A-5ool5:
24.07
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.
5vso YEAST DNAJ PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 3 LYS A  28
TYR A  31
ARG A  32
 None
 1.16A 4gc9A-5vsoA:
undetectable		 4gc9A-5vsoA:
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.
5vye L-THREONINE ALDOLASE

(Pseudomonas
putida) 		no annotation 3 LYS A 128
TYR A 134
ARG A 129
 None
 1.26A 4gc9A-5vyeA:
undetectable		 4gc9A-5vyeA:
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.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum) 		no annotation 3 LYS A 604
TYR A 607
ARG A 608
 None
 0.96A 4gc9A-5xqoA:
undetectable		 4gc9A-5xqoA:
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.
5yhb POLYHEDRIN

(Cypovirus 1) 		no annotation 3 LYS A 135
TYR A 136
ARG A 139
 None
 1.19A 4gc9A-5yhbA:
undetectable		 4gc9A-5yhbA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ao5 SERINE/THREONINE-PRO
TEIN KINASE 3

(Homo sapiens) 		no annotation 3 LYS A 473
TYR A 470
ARG A 469
 None
 1.21A 4gc9A-6ao5A:
undetectable		 4gc9A-6ao5A:
22.20
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.
6etx DNA HELICASE INO80

(Homo sapiens) 		no annotation 3 LYS G 842
TYR G 845
ARG G 846
 None
 1.10A 4gc9A-6etxG:
undetectable		 4gc9A-6etxG:
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.
9rub RIBULOSE-1,5-BISPHOS
PHATE CARBOXYLASE

(Rhodospirillum
rubrum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 LYS A 122
TYR A 120
ARG A 301
 None
 1.17A 4gc9A-9rubA:
undetectable		 4gc9A-9rubA:
20.41