SIMILAR PATTERNS OF AMINO ACIDS FOR 4QZU_D_ACTD201

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.
1alq CP254 BETA-LACTAMASE

(Staphylococcus
aureus)
PF13354
(Beta-lactamase2)
3 ASP A 268
HIS A  43
LYS A 267
None
0.89A 4qzuD-1alqA:
undetectable
4qzuD-1alqA:
18.50
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.
1jv1 GLCNAC1P
URIDYLTRANSFERASE
ISOFORM 1: AGX1


(Homo sapiens)
PF01704
(UDPGP)
3 ASP A 384
HIS A 352
LYS A 380
None
0.77A 4qzuD-1jv1A:
0.0
4qzuD-1jv1A:
13.88
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.
1mc0 3',5'-CYCLIC
NUCLEOTIDE
PHOSPHODIESTERASE 2A


(Mus musculus)
PF01590
(GAF)
PF13185
(GAF_2)
3 ASP A 219
HIS A 361
LYS A 221
None
0.96A 4qzuD-1mc0A:
0.6
4qzuD-1mc0A:
15.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p7b INTEGRAL MEMBRANE
CHANNEL AND
CYTOSOLIC DOMAINS


(Burkholderia
pseudomallei)
PF01007
(IRK)
3 ASP A 211
HIS A 230
LYS A 213
None
0.90A 4qzuD-1p7bA:
1.2
4qzuD-1p7bA:
16.05
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.
1pio BETA-LACTAMASE

(Staphylococcus
aureus)
PF13354
(Beta-lactamase2)
3 ASP A 268
HIS A  43
LYS A 267
None
1.00A 4qzuD-1pioA:
0.8
4qzuD-1pioA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1poc PHOSPHOLIPASE A2

(Apis mellifera)
PF05826
(Phospholip_A2_2)
3 ASP A  64
HIS A  34
LYS A  66
None
GEL  A 420 (-3.7A)
None
0.79A 4qzuD-1pocA:
0.0
4qzuD-1pocA:
21.23
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.
1pvj PYROGENIC EXOTOXIN B

(Streptococcus
pyogenes)
PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69)
3 ASP A 154
HIS A 354
LYS A 150
None
0.54A 4qzuD-1pvjA:
0.0
4qzuD-1pvjA:
17.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1td0 HEAD DECORATION
PROTEIN


(Escherichia
virus Lambda)
PF02924
(HDPD)
3 ASP A  95
HIS A  97
LYS A  99
None
0.94A 4qzuD-1td0A:
undetectable
4qzuD-1td0A:
15.89
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.
1wdy 2-5A-DEPENDENT
RIBONUCLEASE


(Homo sapiens)
PF12796
(Ank_2)
PF13857
(Ank_5)
3 ASP A 189
HIS A 228
LYS A 185
None
1.01A 4qzuD-1wdyA:
undetectable
4qzuD-1wdyA:
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.
1xrc S-ADENOSYLMETHIONINE
SYNTHETASE


(Escherichia
coli)
PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C)
3 ASP A  16
HIS A  14
LYS A  17
None
1.00A 4qzuD-1xrcA:
0.0
4qzuD-1xrcA:
15.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xss FLUORESCENT PROTEIN

(Favia favus)
PF01353
(GFP)
3 ASP A 195
HIS A 219
LYS A 217
None
0.76A 4qzuD-1xssA:
undetectable
4qzuD-1xssA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zba COAT PROTEIN VP2

(Foot-and-mouth
disease virus)
PF00073
(Rhv)
3 ASP 2 169
HIS 2 174
LYS 2 173
None
0.99A 4qzuD-1zba2:
undetectable
4qzuD-1zba2:
19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zvd SMAD UBIQUITINATION
REGULATORY FACTOR 2


(Homo sapiens)
PF00632
(HECT)
3 ASP A 721
HIS A 714
LYS A 712
None
1.00A 4qzuD-1zvdA:
undetectable
4qzuD-1zvdA:
17.40
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.
1zvf 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE


(Saccharomyces
cerevisiae)
PF06052
(3-HAO)
3 ASP A 120
HIS A  49
LYS A 121
None
NI  A 201 (-3.2A)
None
0.77A 4qzuD-1zvfA:
undetectable
4qzuD-1zvfA:
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.
2b9s TOPOISOMERASE I-LIKE
PROTEIN


(Leishmania
donovani)
PF01028
(Topoisom_I)
PF02919
(Topoisom_I_N)
3 ASP A 114
HIS A 118
LYS A 115
None
0.87A 4qzuD-2b9sA:
undetectable
4qzuD-2b9sA:
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.
2cop ACYL-COENZYME A
BINDING DOMAIN
CONTAINING 6


(Homo sapiens)
PF00887
(ACBP)
3 ASP A  88
HIS A  18
LYS A  85
None
1.01A 4qzuD-2copA:
undetectable
4qzuD-2copA:
26.32
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.
2di9 FILAMIN-B

(Homo sapiens)
PF00630
(Filamin)
3 ASP A  55
HIS A  37
LYS A  35
None
0.97A 4qzuD-2di9A:
undetectable
4qzuD-2di9A:
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.
2gmn METALLO-BETA-LACTAMA
SE


(Bradyrhizobium
diazoefficiens)
PF00753
(Lactamase_B)
3 ASP A 105
HIS A 242
LYS A  29
ZN  A 802 (-2.5A)
ZN  A 802 (-3.2A)
None
0.89A 4qzuD-2gmnA:
undetectable
4qzuD-2gmnA:
19.06
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.
2him L-ASPARAGINASE 1

(Escherichia
coli)
PF00710
(Asparaginase)
3 ASP A  74
HIS A  78
LYS A  76
None
0.85A 4qzuD-2himA:
undetectable
4qzuD-2himA:
17.55
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.
2jgd 2-OXOGLUTARATE
DEHYDROGENASE E1
COMPONENT


(Escherichia
coli)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C)
3 ASP A 294
HIS A 298
LYS A 296
None
0.92A 4qzuD-2jgdA:
undetectable
4qzuD-2jgdA:
10.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jtc STREPTOPAIN

(Streptococcus
pyogenes)
PF01640
(Peptidase_C10)
3 ASP A   9
HIS A 209
LYS A   5
None
0.74A 4qzuD-2jtcA:
undetectable
4qzuD-2jtcA:
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.
2kdg MYOTILIN

(Homo sapiens)
PF07679
(I-set)
3 ASP A 293
HIS A 296
LYS A 297
None
0.79A 4qzuD-2kdgA:
undetectable
4qzuD-2kdgA:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ose PROBABLE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Mimivirus)
PF00160
(Pro_isomerase)
3 ASP A  94
HIS A  82
LYS A  80
None
0.96A 4qzuD-2oseA:
undetectable
4qzuD-2oseA:
21.89
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.
2pun METHYLTHIORIBOSE
KINASE


(Bacillus
subtilis)
PF01636
(APH)
3 ASP A 116
HIS A  48
LYS A  56
ACP  A 999 (-4.6A)
None
None
0.90A 4qzuD-2punA:
undetectable
4qzuD-2punA:
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.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE


(Bacillus
halodurans)
PF00294
(PfkB)
3 ASP A  92
HIS A  96
LYS A  97
None
0.93A 4qzuD-2qcvA:
undetectable
4qzuD-2qcvA:
17.23
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.
2x5f ASPARTATE_TYROSINE_P
HENYLALANINE
PYRIDOXAL-5'
PHOSPHATE-DEPENDENT
AMINOTRANSFERASE


(Staphylococcus
aureus)
PF00155
(Aminotran_1_2)
3 ASP A 425
HIS A 357
LYS A 422
None
0.86A 4qzuD-2x5fA:
undetectable
4qzuD-2x5fA:
17.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xuz IRON-UPTAKE
SYSTEM-BINDING
PROTEIN


(Bacillus
subtilis)
PF01497
(Peripla_BP_2)
3 ASP A  54
HIS A  56
LYS A  51
None
0.86A 4qzuD-2xuzA:
undetectable
4qzuD-2xuzA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xw7 DIHYDROFOLATE
REDUCTASE


(Mycolicibacterium
smegmatis)
PF01872
(RibD_C)
3 ASP A 108
HIS A  -1
LYS A 107
None
0.93A 4qzuD-2xw7A:
undetectable
4qzuD-2xw7A:
18.99
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.
2z7j CAPSID ASSEMBLY
PROTEIN VP3


(Infectious
bursal disease
virus)
PF01767
(Birna_VP3)
3 ASP A 101
HIS A 126
LYS A  96
None
1.00A 4qzuD-2z7jA:
undetectable
4qzuD-2z7jA:
19.15
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.
3aeb SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL


(Sus scrofa)
PF13085
(Fer2_3)
PF13534
(Fer4_17)
3 ASP B  26
HIS B  29
LYS B  27
None
0.84A 4qzuD-3aebB:
undetectable
4qzuD-3aebB:
19.11
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.
3beu TRYPSIN

(Streptomyces
griseus)
PF00089
(Trypsin)
3 ASP A 102
HIS A  57
LYS A  96
None
SO4  A 246 ( 3.8A)
None
0.85A 4qzuD-3beuA:
undetectable
4qzuD-3beuA:
20.45
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.
3cbg O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803)
PF01596
(Methyltransf_3)
3 ASP A 212
HIS A 174
LYS A   3
None
4FE  A 502 ( 4.3A)
None
0.90A 4qzuD-3cbgA:
undetectable
4qzuD-3cbgA:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cfz UPF0100 PROTEIN
MJ1186


(Methanocaldococcus
jannaschii)
PF13531
(SBP_bac_11)
3 ASP A  90
HIS A 299
LYS A 300
None
0.83A 4qzuD-3cfzA:
undetectable
4qzuD-3cfzA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dra GERANYLGERANYLTRANSF
ERASE TYPE I BETA
SUBUNIT


(Candida
albicans)
PF00432
(Prenyltrans)
3 ASP B 175
HIS B 170
LYS B 173
None
0.90A 4qzuD-3draB:
undetectable
4qzuD-3draB:
14.10
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.
3dtn PUTATIVE
METHYLTRANSFERASE
MM_2633


(Methanosarcina
mazei)
PF13649
(Methyltransf_25)
3 ASP A 187
HIS A 118
LYS A 188
None
0.88A 4qzuD-3dtnA:
undetectable
4qzuD-3dtnA:
21.33
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.
3e8t TAKEOUT-LIKE PROTEIN
1


(Epiphyas
postvittana)
PF06585
(JHBP)
3 ASP A 134
HIS A 140
LYS A 133
None
0.93A 4qzuD-3e8tA:
undetectable
4qzuD-3e8tA:
25.12
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.
3eaa EVPC

(Edwardsiella
tarda)
PF05638
(T6SS_HCP)
3 ASP A  18
HIS A  21
LYS A  22
None
0.95A 4qzuD-3eaaA:
undetectable
4qzuD-3eaaA:
25.00
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.
3h68 SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5


(Homo sapiens)
PF00149
(Metallophos)
PF08321
(PPP5)
3 ASP A 453
HIS A 481
LYS A 485
None
0.99A 4qzuD-3h68A:
undetectable
4qzuD-3h68A:
17.03
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.
3i9f PUTATIVE TYPE 11
METHYLTRANSFERASE


(Sulfolobus
solfataricus)
PF08241
(Methyltransf_11)
3 ASP A 118
HIS A 184
LYS A 117
ZN  A   1 (-2.1A)
ZN  A   1 (-3.2A)
None
0.79A 4qzuD-3i9fA:
undetectable
4qzuD-3i9fA:
22.89
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.
3k0y PUTATIVE TOXIN
RELATED PROTEIN


(Parabacteroides
distasonis)
PF12667
(NigD_N)
PF17415
(NigD_C)
3 ASP A  58
HIS A  98
LYS A  59
None
0.85A 4qzuD-3k0yA:
undetectable
4qzuD-3k0yA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l1f ALPHA-CRYSTALLIN A
CHAIN


(Bos taurus)
PF00011
(HSP20)
3 ASP A  84
HIS A 100
LYS A  99
None
0.96A 4qzuD-3l1fA:
undetectable
4qzuD-3l1fA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l4k DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C)
3 ASP A1158
HIS A 796
LYS A 793
None
0.83A 4qzuD-3l4kA:
undetectable
4qzuD-3l4kA:
10.11
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.
3nm1 THIAMINE
BIOSYNTHETIC
BIFUNCTIONAL ENZYME


([Candida]
glabrata)
PF02110
(HK)
PF02581
(TMP-TENI)
3 ASP A  87
HIS A  66
LYS A   2
None
1.00A 4qzuD-3nm1A:
undetectable
4qzuD-3nm1A:
12.80
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.
3pfe SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE


(Legionella
pneumophila)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
3 ASP A 129
HIS A  96
LYS A  99
ZN  A 502 ( 2.3A)
ZN  A 501 (-3.3A)
None
0.99A 4qzuD-3pfeA:
undetectable
4qzuD-3pfeA:
16.01
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.
3r3r FERRIPYOCHELIN
BINDING PROTEIN


(Salmonella
enterica)
PF00132
(Hexapep)
3 ASP A  62
HIS A  91
LYS A  92
None
0.97A 4qzuD-3r3rA:
undetectable
4qzuD-3r3rA:
23.46
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.
3rhy N(G),N(G)-DIMETHYLAR
GININE
DIMETHYLAMINOHYDROLA
SE


(Pseudomonas
aeruginosa)
PF02274
(Amidinotransf)
3 ASP A 117
HIS A 162
LYS A 164
None
HM3  A 255 (-3.7A)
None
0.99A 4qzuD-3rhyA:
undetectable
4qzuD-3rhyA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s3r CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)


(Schistosoma
mansoni)
PF00112
(Peptidase_C1)
3 ASP A 250
HIS A 261
LYS A 260
None
0.97A 4qzuD-3s3rA:
undetectable
4qzuD-3s3rA:
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.
3uor ABC TRANSPORTER
SUGAR BINDING
PROTEIN


(Xanthomonas
citri)
PF13416
(SBP_bac_8)
3 ASP A  83
HIS A 311
LYS A 312
None
0.77A 4qzuD-3uorA:
undetectable
4qzuD-3uorA:
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.
3v10 RHUSIOPATHIAE
SURFACE PROTEIN B


(Erysipelothrix
rhusiopathiae)
PF05737
(Collagen_bind)
3 ASP A 247
HIS A 256
LYS A 255
None
0.91A 4qzuD-3v10A:
undetectable
4qzuD-3v10A:
18.69
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.
3v4h HYPOTHETICAL PROTEIN

(Yersinia pestis)
PF05638
(T6SS_HCP)
3 ASP A 103
HIS A  78
LYS A  80
None
0.78A 4qzuD-3v4hA:
undetectable
4qzuD-3v4hA:
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.
3vr1 PEPTIDE CHAIN
RELEASE FACTOR 3


(Desulfovibrio
vulgaris)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF16658
(RF3_C)
3 ASP A 183
HIS A 186
LYS A 187
None
0.91A 4qzuD-3vr1A:
undetectable
4qzuD-3vr1A:
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.
4a5o BIFUNCTIONAL PROTEIN
FOLD


(Pseudomonas
aeruginosa)
PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C)
3 ASP A  57
HIS A  53
LYS A  54
None
0.83A 4qzuD-4a5oA:
undetectable
4qzuD-4a5oA:
15.14
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.
4buc UDP-N-ACETYLMURAMOYL
ALANINE--D-GLUTAMATE
LIGASE


(Thermotoga
maritima)
PF08245
(Mur_ligase_M)
3 ASP A 306
HIS A 142
LYS A 308
None
0.76A 4qzuD-4bucA:
undetectable
4qzuD-4bucA:
17.09
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.
4c22 L-FUCOSE ISOMERASE

(Streptococcus
pneumoniae)
PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2)
3 ASP A  47
HIS A   4
LYS A  44
None
1.01A 4qzuD-4c22A:
undetectable
4qzuD-4c22A:
11.61
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.
4cxh ELONGATION FACTOR 1A

(Oryctolagus
cuniculus)
PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
3 ASP A 263
HIS A 315
LYS A 264
None
0.99A 4qzuD-4cxhA:
undetectable
4qzuD-4cxhA:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fg8 CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE 1


(Homo sapiens)
PF00069
(Pkinase)
3 ASP A 127
HIS A  75
LYS A 130
None
0.92A 4qzuD-4fg8A:
undetectable
4qzuD-4fg8A:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g9z NUCLEOPROTEIN

(Lassa
mammarenavirus)
PF17290
(Arena_ncap_C)
3 ASP A 504
HIS A 507
LYS A 503
None
0.90A 4qzuD-4g9zA:
undetectable
4qzuD-4g9zA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gb7 6-AMINOHEXANOATE-DIM
ER HYDROLASE


(Bacillus
anthracis)
PF00144
(Beta-lactamase)
3 ASP A  46
HIS A 198
LYS A  42
None
0.96A 4qzuD-4gb7A:
undetectable
4qzuD-4gb7A:
14.75
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.
4gbf PHIKZ131

(Pseudomonas
virus phiKZ)
no annotation 3 ASP A 426
HIS A 762
LYS A 761
None
0.99A 4qzuD-4gbfA:
undetectable
4qzuD-4gbfA:
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.
4gfh DNA TOPOISOMERASE 2

(Saccharomyces
cerevisiae)
PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF02518
(HATPase_c)
PF16898
(TOPRIM_C)
3 ASP A1158
HIS A 796
LYS A 793
None
0.93A 4qzuD-4gfhA:
undetectable
4qzuD-4gfhA:
7.97
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.
4gu3 OUTER CAPSID PROTEIN
SIGMA-1


(Mammalian
orthoreovirus)
PF01664
(Reo_sigma1)
3 ASP A 380
HIS A 345
LYS A 382
None
0.75A 4qzuD-4gu3A:
undetectable
4qzuD-4gu3A:
19.73
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.
4i04 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)


(Schistosoma
mansoni)
PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1)
3 ASP A 250
HIS A 261
LYS A 260
None
0.98A 4qzuD-4i04A:
undetectable
4qzuD-4i04A:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i05 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)


(Schistosoma
mansoni)
PF00112
(Peptidase_C1)
3 ASP A 250
HIS A 261
LYS A 260
None
0.97A 4qzuD-4i05A:
undetectable
4qzuD-4i05A:
16.84
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.
4j91 KTR SYSTEM POTASSIUM
UPTAKE PROTEIN A


(Bacillus
subtilis)
PF02080
(TrkA_C)
PF02254
(TrkA_N)
3 ASP A 203
HIS A 185
LYS A 184
None
1.01A 4qzuD-4j91A:
undetectable
4qzuD-4j91A:
19.56
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.
4jhz BETA-GLUCURONIDASE

(Escherichia
coli)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 ASP A 399
HIS A 402
LYS A 400
None
0.93A 4qzuD-4jhzA:
undetectable
4qzuD-4jhzA:
13.73
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.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE


(Vibrio cholerae)
PF01135
(PCMT)
3 ASP A   7
HIS A  28
LYS A   5
None
0.85A 4qzuD-4l7vA:
undetectable
4qzuD-4l7vA:
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.
4oav PROTEIN (RNASE L)

(Homo sapiens)
PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A)
PF12796
(Ank_2)
PF13857
(Ank_5)
3 ASP B 189
HIS B 228
LYS B 185
None
0.94A 4qzuD-4oavB:
undetectable
4qzuD-4oavB:
11.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r6k SOLUTE-BINDING
PROTEIN


(Bacillus
subtilis)
PF13416
(SBP_bac_8)
3 ASP A  70
HIS A 297
LYS A 298
None
0.88A 4qzuD-4r6kA:
undetectable
4qzuD-4r6kA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r8f VACUOLAR
AMINOPEPTIDASE 1


(Saccharomyces
cerevisiae)
PF02127
(Peptidase_M18)
3 ASP A 341
HIS A  88
LYS A 410
None
0.80A 4qzuD-4r8fA:
undetectable
4qzuD-4r8fA:
13.40
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.
4rk2 PUTATIVE SUGAR ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN


(Rhizobium etli)
PF01547
(SBP_bac_1)
3 ASP A  90
HIS A 319
LYS A 320
None
0.78A 4qzuD-4rk2A:
undetectable
4qzuD-4rk2A:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uzy FLAGELLAR ASSOCIATED
PROTEIN


(Chlamydomonas
reinhardtii)
PF12895
(ANAPC3)
PF13174
(TPR_6)
3 ASP A  82
HIS A 110
LYS A  84
None
0.94A 4qzuD-4uzyA:
undetectable
4qzuD-4uzyA:
12.50
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.
4xc5 OUTER CAPSID PROTEIN
SIGMA-1


(Mammalian
orthoreovirus)
PF01664
(Reo_sigma1)
3 ASP A 380
HIS A 345
LYS A 382
None
1.01A 4qzuD-4xc5A:
undetectable
4qzuD-4xc5A:
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.
4y0e PUTATIVE DIOXYGENASE

(Mycobacteroides
abscessus)
PF02668
(TauD)
3 ASP A 256
HIS A 200
LYS A 115
MPD  A 402 (-3.5A)
MPD  A 402 (-4.5A)
MPD  A 402 (-3.3A)
0.95A 4qzuD-4y0eA:
undetectable
4qzuD-4y0eA:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zze SUGAR BINDING
PROTEIN OF ABC
TRANSPORTER SYSTEM


(Bifidobacterium
animalis)
PF01547
(SBP_bac_1)
3 ASP A 104
HIS A 337
LYS A 338
None
0.95A 4qzuD-4zzeA:
undetectable
4qzuD-4zzeA:
13.18
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.
5b4x LOW DENSITY
LIPOPROTEIN
RECEPTOR-RELATED
PROTEIN 8,
APOLIPOPROTEIN E
RECEPTOR, ISOFORM
CRA_E


(Homo sapiens)
PF00057
(Ldl_recept_a)
PF00058
(Ldl_recept_b)
PF07645
(EGF_CA)
PF14670
(FXa_inhibition)
3 ASP B 375
HIS B 378
LYS B 379
None
0.75A 4qzuD-5b4xB:
undetectable
4qzuD-5b4xB:
10.70
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.
5c59 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB


(Escherichia
coli)
PF12704
(MacB_PCD)
3 ASP A 205
HIS A 201
LYS A 204
None
0.93A 4qzuD-5c59A:
undetectable
4qzuD-5c59A:
23.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c70 GLUCURONIDASE

(Aspergillus
oryzae)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 ASP A 400
HIS A 403
LYS A 401
None
0.90A 4qzuD-5c70A:
undetectable
4qzuD-5c70A:
13.13
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.
5du3 PLASMA PROTEASE C1
INHIBITOR


(Homo sapiens)
PF00079
(Serpin)
3 ASP A 461
HIS A 464
LYS A 465
None
1.01A 4qzuD-5du3A:
undetectable
4qzuD-5du3A:
17.74
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.
5eqv BIFUNCTIONAL
2',3'-CYCLIC
NUCLEOTIDE
2'-PHOSPHODIESTERASE
/3'-NUCLEOTIDASE
PERIPLASMIC
PRECURSOR PROTEIN


(Yersinia pestis)
PF00149
(Metallophos)
3 ASP A 172
HIS A 178
LYS A 171
None
0.99A 4qzuD-5eqvA:
undetectable
4qzuD-5eqvA:
15.52
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.
5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S


(Oryctolagus
cuniculus)
PF00520
(Ion_trans)
PF08763
(Ca_chan_IQ)
PF16905
(GPHH)
3 ASP A1030
HIS A 454
LYS A 953
None
0.79A 4qzuD-5gjvA:
undetectable
4qzuD-5gjvA:
5.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN


(Exiguobacterium
antarcticum)
PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4)
3 ASP A 220
HIS A 216
LYS A 218
None
0.94A 4qzuD-5h3hA:
undetectable
4qzuD-5h3hA:
19.25
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00202
(Aminotran_3)
3 ASP A  63
HIS A  75
LYS A  52
None
0.96A 4qzuD-5hdmA:
undetectable
4qzuD-5hdmA:
14.92
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.
5isx GRAMICIDIN S
SYNTHASE 1


(Brevibacillus
brevis)
PF00550
(PP-binding)
PF00668
(Condensation)
3 ASP A 767
HIS A 672
LYS A 667
None
1.00A 4qzuD-5isxA:
undetectable
4qzuD-5isxA:
13.19
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.
5jjt SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5


(Arabidopsis
thaliana)
PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5)
PF13431
(TPR_17)
3 ASP A 439
HIS A 467
LYS A 471
None
0.90A 4qzuD-5jjtA:
undetectable
4qzuD-5jjtA:
15.27
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.
5l0z PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY


(Sinorhizobium
meliloti)
PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind)
3 ASP A  31
HIS A  40
LYS A  30
CO  A 301 ( 4.6A)
CO  A 301 (-3.1A)
None
0.93A 4qzuD-5l0zA:
undetectable
4qzuD-5l0zA:
17.14
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.
5lj8 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB


(Escherichia
coli)
no annotation 3 ASP A 501
HIS A 497
LYS A 500
None
1.00A 4qzuD-5lj8A:
undetectable
4qzuD-5lj8A:
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.
5lkz HISTONE
ACETYLTRANSFERASE
P300,HISTONE
ACETYLTRANSFERASE
P300


(Homo sapiens)
PF00439
(Bromodomain)
PF06001
(DUF902)
PF08214
(HAT_KAT11)
3 ASP A1454
HIS A1402
LYS A1456
None
None
COO  A1705 (-3.7A)
1.00A 4qzuD-5lkzA:
undetectable
4qzuD-5lkzA:
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.
5msy GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron)
PF12904
(Collagen_bind_2)
PF13204
(DUF4038)
3 ASP A 442
HIS A 446
LYS A 423
None
1.00A 4qzuD-5msyA:
undetectable
4qzuD-5msyA:
13.88
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.
5uds LACTATE RACEMIZATION
OPERON PROTEIN LARE


(Lactobacillus
plantarum)
PF02540
(NAD_synthase)
3 ASP A  86
HIS A  88
LYS A  90
None
0.98A 4qzuD-5udsA:
undetectable
4qzuD-5udsA:
17.36
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.
5ux4 CATHEPSIN D

(Rattus
norvegicus)
no annotation 3 ASP A 127
HIS A  57
LYS A  58
None
0.94A 4qzuD-5ux4A:
undetectable
4qzuD-5ux4A:
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.
5v8e BACILLUS CEREUS
PATB1


(Bacillus cereus)
no annotation 3 ASP A 283
HIS A 289
LYS A 282
None
0.96A 4qzuD-5v8eA:
undetectable
4qzuD-5v8eA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w21 KLOTHO

(Homo sapiens)
no annotation 3 ASP A 381
HIS A 383
LYS A 385
None
0.96A 4qzuD-5w21A:
undetectable
4qzuD-5w21A:
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.
5xii PROLYL-TRNA
SYNTHETASE (PRORS)


(Toxoplasma
gondii)
no annotation 3 ASP A 576
HIS A 580
LYS A 581
None
1.00A 4qzuD-5xiiA:
undetectable
4qzuD-5xiiA:
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.
5xsx CHITINASE

(Thermococcus
chitonophagus)
no annotation 3 ASP A 566
HIS A 593
LYS A 598
GOL  A1003 (-3.3A)
GOL  A1003 ( 4.6A)
None
0.90A 4qzuD-5xsxA:
undetectable
4qzuD-5xsxA:
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.
5y00 GREEN FLUORESCENT
PROTEIN


(Olindias)
no annotation 3 ASP A 214
HIS A  50
LYS A 210
None
0.95A 4qzuD-5y00A:
undetectable
4qzuD-5y00A:
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.
5yy3 -

(-)
no annotation 3 ASP A  58
HIS A  59
LYS A  60
None
0.98A 4qzuD-5yy3A:
undetectable
4qzuD-5yy3A:
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis)
no annotation 3 ASP A 223
HIS A 221
LYS A 216
None
0.99A 4qzuD-5z06A:
undetectable
4qzuD-5z06A:
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.
5zvt C-TERMINUS OF OUTER
CAPSID PROTEIN VP5


(Aquareovirus C)
no annotation 3 ASP B 229
HIS B 233
LYS B 219
None
0.99A 4qzuD-5zvtB:
undetectable
4qzuD-5zvtB:
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.
6ezn DOLICHYL-DIPHOSPHOOL
IGOSACCHARIDE--PROTE
IN
GLYCOSYLTRANSFERASE
SUBUNIT WBP1


(Saccharomyces
cerevisiae)
no annotation 3 ASP G 288
HIS G 273
LYS G 289
None
1.02A 4qzuD-6eznG:
undetectable
4qzuD-6eznG:
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.
6fos PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2


(Cyanidioschyzon
merolae)
no annotation 3 ASP D  80
HIS D  96
LYS D  82
None
0.82A 4qzuD-6fosD:
undetectable
4qzuD-6fosD:
undetectable