SIMILAR PATTERNS OF AMINO ACIDS FOR 4L4G_A_CAMA503_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.
1ag9 FLAVODOXIN

(Escherichia
coli)
PF00258
(Flavodoxin_1)
4 THR A   4
LEU A  26
VAL A 161
VAL A 117
None
0.98A 4l4gA-1ag9A:
0.0
4l4gA-1ag9A:
24.05
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.
1ahs AFRICAN HORSE
SICKNESS VIRUS
(SEROTYPE 4) VP7


(African horse
sickness virus)
PF00897
(Orbi_VP7)
4 THR A 126
VAL A 247
VAL A 182
ASP A 180
None
1.02A 4l4gA-1ahsA:
0.0
4l4gA-1ahsA:
14.89
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.
1ce7 PROTEIN
(RIBOSOME-INACTIVATI
NG PROTEIN TYPE II)


(Viscum album)
PF00161
(RIP)
4 PHE A  20
LEU A 154
VAL A  67
ASP A   7
None
1.07A 4l4gA-1ce7A:
0.0
4l4gA-1ce7A:
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.
1gpm GMP SYNTHETASE

(Escherichia
coli)
PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase)
4 THR A 449
LEU A 472
VAL A 496
VAL A 504
None
1.05A 4l4gA-1gpmA:
0.0
4l4gA-1gpmA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lfp HYPOTHETICAL PROTEIN
AQ_1575


(Aquifex
aeolicus)
PF01709
(Transcrip_reg)
4 PHE A 117
LEU A 222
VAL A 234
VAL A 130
None
0.83A 4l4gA-1lfpA:
0.0
4l4gA-1lfpA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mb9 BETA-LACTAM
SYNTHETASE


(Streptomyces
clavuligerus)
PF00733
(Asn_synthase)
PF13537
(GATase_7)
4 THR A 396
LEU A 345
VAL A 257
VAL A 404
None
1.03A 4l4gA-1mb9A:
undetectable
4l4gA-1mb9A:
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.
1mpx ALPHA-AMINO ACID
ESTER HYDROLASE


(Xanthomonas
citri)
PF02129
(Peptidase_S15)
PF08530
(PepX_C)
4 PHE A 107
THR A  78
VAL A 195
ASP A 104
None
1.00A 4l4gA-1mpxA:
0.0
4l4gA-1mpxA:
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.
1s7h YKOF

(Bacillus
subtilis)
PF07615
(Ykof)
4 PHE A  59
LEU A 187
VAL A 185
VAL A 170
None
1.06A 4l4gA-1s7hA:
undetectable
4l4gA-1s7hA:
17.94
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.
1ygp YEAST GLYCOGEN
PHOSPHORYLASE


(Saccharomyces
cerevisiae)
PF00343
(Phosphorylase)
4 THR A 506
LEU A 521
VAL A 802
VAL A 537
None
0.88A 4l4gA-1ygpA:
0.0
4l4gA-1ygpA:
19.08
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.
1yyr TRICHODIENE SYNTHASE

(Fusarium
sporotrichioides)
PF06330
(TRI5)
4 TYR A  93
LEU A 150
VAL A 138
VAL A  81
SAZ  A 709 (-4.9A)
None
None
None
0.92A 4l4gA-1yyrA:
undetectable
4l4gA-1yyrA:
23.04
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.
2awa DNA POLYMERASE III,
BETA CHAIN


(Streptococcus
pneumoniae)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
4 PHE A  11
LEU A  77
VAL A  34
VAL A  38
None
1.00A 4l4gA-2awaA:
undetectable
4l4gA-2awaA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b7h HEMOGLOBIN ALPHA
CHAIN


(Cerdocyon thous)
PF00042
(Globin)
4 PHE A  43
THR A  32
VAL A  62
VAL A  93
HEM  A 200 (-3.5A)
None
HEM  A 200 ( 3.8A)
HEM  A 200 (-4.3A)
0.92A 4l4gA-2b7hA:
undetectable
4l4gA-2b7hA:
17.35
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.
2c9i GREEN FLUORESCENT
PROTEIN ASFP499


(Anemonia
sulcata)
PF01353
(GFP)
4 PHE A  80
TYR A 178
VAL A 147
VAL A 214
None
1.03A 4l4gA-2c9iA:
undetectable
4l4gA-2c9iA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cf5 CINNAMYL ALCOHOL
DEHYDROGENASE


(Arabidopsis
thaliana)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 TYR A  27
THR A  10
LEU A  29
VAL A  71
None
1.03A 4l4gA-2cf5A:
undetectable
4l4gA-2cf5A:
21.98
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.
2dwz 26S PROTEASE
REGULATORY SUBUNIT
6B


(Rattus
norvegicus)
no annotation 4 THR B 349
LEU B 354
VAL B 358
VAL B 364
None
0.91A 4l4gA-2dwzB:
undetectable
4l4gA-2dwzB:
11.35
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.
2f43 ATP SYNTHASE ALPHA
CHAIN, MITOCHONDRIAL


(Rattus
norvegicus)
PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N)
4 THR A 176
LEU A 216
VAL A 213
ASP A 270
MG  A 602 ( 3.3A)
None
None
MG  A 602 ( 4.8A)
0.88A 4l4gA-2f43A:
undetectable
4l4gA-2f43A:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h4t CARNITINE
O-PALMITOYLTRANSFERA
SE II, MITOCHONDRIAL


(Rattus
norvegicus)
PF00755
(Carn_acyltransf)
4 PHE A 221
THR A 165
LEU A  35
VAL A 387
None
1.05A 4l4gA-2h4tA:
undetectable
4l4gA-2h4tA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i62 NICOTINAMIDE
N-METHYLTRANSFERASE


(Mus musculus)
PF01234
(NNMT_PNMT_TEMT)
4 PHE A 254
LEU A 194
VAL A 226
ASP A 198
None
0.94A 4l4gA-2i62A:
undetectable
4l4gA-2i62A:
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.
2k8d PEPTIDE METHIONINE
SULFOXIDE REDUCTASE
MSRB


(Methanothermobacter
thermautotrophicus)
PF01641
(SelR)
4 PHE A  90
LEU A 123
VAL A 114
VAL A  94
None
0.93A 4l4gA-2k8dA:
undetectable
4l4gA-2k8dA:
17.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2m56 CAMPHOR
5-MONOOXYGENASE


(Pseudomonas
putida)
PF00067
(p450)
4 PHE A  87
TYR A  96
LEU A 244
VAL A 396
CAM  A 502 (-4.6A)
CAM  A 502 (-4.5A)
HEM  A 501 (-4.5A)
None
0.76A 4l4gA-2m56A:
67.4
4l4gA-2m56A:
99.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2m56 CAMPHOR
5-MONOOXYGENASE


(Pseudomonas
putida)
PF00067
(p450)
7 PHE A  87
TYR A  96
THR A 101
LEU A 244
VAL A 247
VAL A 295
ASP A 297
CAM  A 502 (-4.6A)
CAM  A 502 (-4.5A)
HEM  A 501 (-2.9A)
HEM  A 501 (-4.5A)
None
HEM  A 501 (-4.6A)
HEM  A 501 (-2.8A)
0.41A 4l4gA-2m56A:
67.4
4l4gA-2m56A:
99.01
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.
2m83 PROTEIN PHOSPHATASE
1 REGULATORY SUBUNIT
3A


(Oryctolagus
cuniculus)
PF03370
(CBM_21)
4 THR A 135
LEU A 231
VAL A 207
VAL A 161
None
1.07A 4l4gA-2m83A:
undetectable
4l4gA-2m83A:
16.14
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.
2n67 HEMOLYSIN II

(Bacillus cereus)
no annotation 4 PHE B  66
TYR B  64
LEU B  36
VAL B  16
None
1.04A 4l4gA-2n67B:
undetectable
4l4gA-2n67B:
13.39
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.
2p17 PIRIN-LIKE PROTEIN

(Geobacillus
kaustophilus)
PF02678
(Pirin)
PF05726
(Pirin_C)
4 THR A 161
LEU A 132
VAL A  88
VAL A 116
None
1.05A 4l4gA-2p17A:
undetectable
4l4gA-2p17A:
19.14
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.
2r8r SENSOR PROTEIN

(Pseudomonas
syringae group
genomosp. 3)
PF02702
(KdpD)
4 THR A 204
LEU A   8
VAL A 121
ASP A 147
None
0.85A 4l4gA-2r8rA:
undetectable
4l4gA-2r8rA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wjf TYROSINE-PROTEIN
PHOSPHATASE CPSB


(Streptococcus
pneumoniae)
no annotation 4 THR A  40
LEU A 106
VAL A 133
ASP A   3
None
1.05A 4l4gA-2wjfA:
undetectable
4l4gA-2wjfA:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wsm HYDROGENASE
EXPRESSION/FORMATION
PROTEIN (HYPB)


(Archaeoglobus
fulgidus)
PF02492
(cobW)
4 THR A  50
LEU A 113
VAL A  33
VAL A 160
None
1.06A 4l4gA-2wsmA:
undetectable
4l4gA-2wsmA:
20.20
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.
2x63 ALPHA-2,3-/2,8-SIALY
LTRANSFERASE


(Campylobacter
jejuni)
PF06002
(CST-I)
4 PHE A  35
TYR A  34
THR A  61
ASP A 242
None
1.06A 4l4gA-2x63A:
undetectable
4l4gA-2x63A:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ymu WD-40 REPEAT PROTEIN

(Nostoc
punctiforme)
PF00400
(WD40)
4 THR A  93
LEU A  90
VAL A  60
ASP A  78
None
1.04A 4l4gA-2ymuA:
undetectable
4l4gA-2ymuA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ymu WD-40 REPEAT PROTEIN

(Nostoc
punctiforme)
PF00400
(WD40)
4 THR A 298
LEU A 295
VAL A 265
ASP A 283
None
1.06A 4l4gA-2ymuA:
undetectable
4l4gA-2ymuA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b5q PUTATIVE SULFATASE
YIDJ


(Bacteroides
thetaiotaomicron)
PF00884
(Sulfatase)
PF16347
(DUF4976)
4 THR A 276
LEU A 267
VAL A 263
VAL A 113
None
1.05A 4l4gA-3b5qA:
undetectable
4l4gA-3b5qA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b9t TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN


(Methylobacillus
flagellatus)
PF03069
(FmdA_AmdA)
4 TYR A 227
LEU A 279
VAL A 278
VAL A 223
None
0.92A 4l4gA-3b9tA:
undetectable
4l4gA-3b9tA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bx8 ENGINEERED HUMAN
LIPOCALIN 2


(Homo sapiens)
PF00061
(Lipocalin)
4 PHE A  83
TYR A  56
THR A  54
VAL A 121
None
None
1PE  A 179 ( 4.7A)
None
0.98A 4l4gA-3bx8A:
undetectable
4l4gA-3bx8A:
17.87
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.
3dqq PUTATIVE TRNA
SYNTHASE


(Salmonella
enterica)
PF07005
(DUF1537)
PF17042
(DUF1357_C)
4 PHE A  11
THR A 368
LEU A 398
VAL A 389
None
1.03A 4l4gA-3dqqA:
undetectable
4l4gA-3dqqA:
23.14
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.
3e0j DNA POLYMERASE
SUBUNIT DELTA-2


(Homo sapiens)
PF04042
(DNA_pol_E_B)
4 THR A 320
VAL A 294
VAL A 276
ASP A 280
None
1.05A 4l4gA-3e0jA:
undetectable
4l4gA-3e0jA:
24.74
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.
3gqp HEMOGLOBIN SUBUNIT
ALPHA


(Felis catus)
PF00042
(Globin)
4 PHE A  43
THR A  32
VAL A  62
VAL A  93
HEM  A 143 (-3.7A)
None
HEM  A 143 ( 4.1A)
HEM  A 143 (-4.1A)
0.97A 4l4gA-3gqpA:
undetectable
4l4gA-3gqpA:
17.54
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.
3jyy LINCOSAMIDE
NUCLEOTIDYLTRANSFERA
SE


(Enterococcus
faecium)
no annotation 4 PHE A  92
LEU A  14
VAL A  11
VAL A  80
None
1.05A 4l4gA-3jyyA:
undetectable
4l4gA-3jyyA:
20.82
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.
3ko7 D-TYROSYL-TRNA(TYR)
DEACYLASE


(Plasmodium
falciparum)
PF02580
(Tyr_Deacylase)
4 LEU A  79
VAL A  76
VAL A 151
ASP A 148
None
0.98A 4l4gA-3ko7A:
undetectable
4l4gA-3ko7A:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lby PUTATIVE
UNCHARACTERIZED
PROTEIN SMU.1697C


(Streptococcus
mutans)
PF06962
(rRNA_methylase)
4 THR A 111
LEU A  94
VAL A 132
VAL A 150
None
0.97A 4l4gA-3lbyA:
undetectable
4l4gA-3lbyA:
18.84
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.
3m1l 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE


(Mycobacterium
tuberculosis)
PF13561
(adh_short_C2)
4 PHE A 431
TYR A 430
THR A 177
LEU A 181
None
1.07A 4l4gA-3m1lA:
undetectable
4l4gA-3m1lA:
22.08
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.
3m9v FAD-DEPENDENT
OXIDOREDUCTASE


(Actinomadura
kijaniata)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
4 THR A 151
LEU A 163
VAL A 199
VAL A 170
None
0.99A 4l4gA-3m9vA:
undetectable
4l4gA-3m9vA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mbt OUTER MEMBRANE
LIPOPROTEIN BLC


(Escherichia
coli)
PF08212
(Lipocalin_2)
4 TYR A  21
LEU A 123
VAL A 112
VAL A  88
None
1.00A 4l4gA-3mbtA:
undetectable
4l4gA-3mbtA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnk UREIDOGLYCINE-GLYOXY
LATE
AMINOTRANSFERASE


(Klebsiella
pneumoniae)
PF00266
(Aminotran_5)
4 THR A 208
LEU A  68
VAL A  51
VAL A  28
None
1.07A 4l4gA-3nnkA:
undetectable
4l4gA-3nnkA:
22.98
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.
3pvl MYOSIN VIIA ISOFORM
1


(Mus musculus)
PF00784
(MyTH4)
4 PHE A1532
LEU A1511
VAL A1498
VAL A1489
None
None
None
GOL  A   1 ( 4.7A)
0.91A 4l4gA-3pvlA:
undetectable
4l4gA-3pvlA:
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.
3rim TRANSKETOLASE

(Mycobacterium
tuberculosis)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
4 THR A 561
LEU A 573
VAL A 600
VAL A 555
None
0.93A 4l4gA-3rimA:
undetectable
4l4gA-3rimA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3skv SSFX3

(Streptomyces
sp. SF2575)
PF13472
(Lipase_GDSL_2)
4 THR A  71
LEU A 152
VAL A 150
VAL A 103
None
1.00A 4l4gA-3skvA:
undetectable
4l4gA-3skvA:
22.48
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.
3sqz PUTATIVE
HYDROXYMETHYLGLUTARY
L-COA SYNTHASE


(Streptococcus
mutans)
PF00195
(Chal_sti_synt_N)
PF08540
(HMG_CoA_synt_C)
4 LEU A  95
VAL A  92
VAL A  82
ASP A  50
None
0.95A 4l4gA-3sqzA:
undetectable
4l4gA-3sqzA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t6g SH2
DOMAIN-CONTAINING
PROTEIN 3C


(Homo sapiens)
PF00617
(RasGEF)
4 PHE A 586
LEU A 590
VAL A 444
ASP A 441
None
0.89A 4l4gA-3t6gA:
undetectable
4l4gA-3t6gA:
22.80
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.
3tos CALS11

(Micromonospora
echinospora)
PF05711
(TylF)
4 THR A 181
LEU A 175
VAL A 171
VAL A 161
None
1.04A 4l4gA-3tosA:
undetectable
4l4gA-3tosA:
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.
3tov GLYCOSYL TRANSFERASE
FAMILY 9


(Veillonella
parvula)
PF01075
(Glyco_transf_9)
4 LEU A 249
VAL A  49
VAL A  61
ASP A  43
None
0.94A 4l4gA-3tovA:
undetectable
4l4gA-3tovA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u9p NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN


(Mus musculus)
PF00061
(Lipocalin)
4 PHE C  79
TYR C  50
THR C  48
VAL C 117
None
1.05A 4l4gA-3u9pC:
undetectable
4l4gA-3u9pC:
17.96
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.
3umf ADENYLATE KINASE

(Schistosoma
mansoni)
PF00406
(ADK)
4 PHE A  13
TYR A  96
LEU A  74
VAL A 110
None
0.86A 4l4gA-3umfA:
undetectable
4l4gA-3umfA:
18.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wbn PUTATIVE
UNCHARACTERIZED
PROTEIN


(Pyrococcus
furiosus)
PF01554
(MatE)
4 THR A 202
LEU A 143
VAL A  45
ASP A  41
OLC  A 505 ( 4.5A)
None
None
None
1.05A 4l4gA-3wbnA:
undetectable
4l4gA-3wbnA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c0r PUTATIVE AMINO ACID
BINDING PROTEIN


(Streptococcus
mutans)
PF00497
(SBP_bac_3)
4 THR A  86
LEU A 211
VAL A  35
ASP A  28
None
1.03A 4l4gA-4c0rA:
undetectable
4l4gA-4c0rA:
18.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans)
PF00067
(p450)
5 TYR A  98
THR A 103
LEU A 252
VAL A 303
ASP A 305
None
GOL  A1419 (-3.8A)
HEM  A1418 (-4.0A)
GOL  A1419 (-3.9A)
HEM  A1418 (-2.7A)
0.61A 4l4gA-4c9mA:
58.5
4l4gA-4c9mA:
45.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans)
PF00067
(p450)
4 TYR A  98
THR A 103
LEU A 252
VAL A 404
None
GOL  A1419 (-3.8A)
HEM  A1418 (-4.0A)
GOL  A1419 (-3.5A)
0.88A 4l4gA-4c9mA:
58.5
4l4gA-4c9mA:
45.39
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.
4czw PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2


(Neurospora
crassa)
PF00929
(RNase_T)
PF13423
(UCH_1)
4 THR A 593
LEU A 508
VAL A 511
VAL A 721
None
0.74A 4l4gA-4czwA:
undetectable
4l4gA-4czwA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d6v G PROTEIN BETA
SUBUNIT GIB2


(Cryptococcus
neoformans)
PF00400
(WD40)
4 THR A 187
LEU A 184
VAL A 151
ASP A 171
None
1.06A 4l4gA-4d6vA:
undetectable
4l4gA-4d6vA:
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.
4ehc PE-PGRS FAMILY
PROTEIN


(Mycobacterium
tuberculosis)
no annotation 4 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.98A 4l4gA-4ehcA:
undetectable
4l4gA-4ehcA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f0q RESTRICTION
ENDONUCLEASE


(Mycobacterium
sp. JLS)
PF04471
(Mrr_cat)
4 THR A 437
LEU A 433
VAL A 418
VAL A 386
None
0.99A 4l4gA-4f0qA:
undetectable
4l4gA-4f0qA:
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.
4f0q RESTRICTION
ENDONUCLEASE


(Mycobacterium
sp. JLS)
PF04471
(Mrr_cat)
4 TYR A 293
THR A 437
LEU A 433
VAL A 418
None
1.03A 4l4gA-4f0qA:
undetectable
4l4gA-4f0qA:
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.
4fgs PROBABLE
DEHYDROGENASE
PROTEIN


(Rhizobium etli)
PF13561
(adh_short_C2)
4 TYR A  72
THR A 119
LEU A  85
VAL A  11
None
1.04A 4l4gA-4fgsA:
undetectable
4l4gA-4fgsA:
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.
4i86 CELLULOSE SYNTHASE 1

(Komagataeibacter
xylinus)
PF07238
(PilZ)
4 PHE A  80
THR A  51
LEU A  47
VAL A  25
None
0.98A 4l4gA-4i86A:
undetectable
4l4gA-4i86A:
13.60
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.
4jdl ABSCISIC ACID
RECEPTOR PYL5


(Arabidopsis
thaliana)
PF10604
(Polyketide_cyc2)
4 THR A 152
LEU A 154
VAL A  73
VAL A  85
None
0.99A 4l4gA-4jdlA:
undetectable
4l4gA-4jdlA:
20.14
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.
4lxf TREHALOSE SYNTHASE

(Mycobacterium
tuberculosis)
PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C)
4 THR A 142
LEU A 209
VAL A 216
VAL A  23
None
1.05A 4l4gA-4lxfA:
undetectable
4l4gA-4lxfA:
21.77
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.
4lxf TREHALOSE SYNTHASE

(Mycobacterium
tuberculosis)
PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C)
4 TYR A 164
THR A 142
VAL A 216
VAL A  23
None
0.92A 4l4gA-4lxfA:
undetectable
4l4gA-4lxfA:
21.77
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.
4m7g TRYPSIN-LIKE
PROTEASE


(Saccharopolyspora
erythraea)
PF00089
(Trypsin)
4 THR A  44
LEU A  92
VAL A  37
VAL A 192
None
1.01A 4l4gA-4m7gA:
undetectable
4l4gA-4m7gA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o0l NADPH-DEPENDENT
3-QUINUCLIDINONE
REDUCTASE


(Rhodotorula
mucilaginosa)
PF13561
(adh_short_C2)
4 PHE A 161
TYR A 110
THR A  34
VAL A 188
None
0.88A 4l4gA-4o0lA:
undetectable
4l4gA-4o0lA:
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.
4q9o ISOPRENYL
TRANSFERASE


(Streptococcus
pneumoniae)
PF01255
(Prenyltransf)
4 PHE A 143
THR A  56
LEU A 102
VAL A  99
2ZW  A 301 (-3.5A)
2ZW  A 301 ( 4.9A)
2ZW  A 301 (-4.5A)
2ZW  A 301 (-4.6A)
1.03A 4l4gA-4q9oA:
undetectable
4l4gA-4q9oA:
20.85
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.
4qae NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN


(Homo sapiens)
PF00061
(Lipocalin)
4 PHE A  83
TYR A  56
THR A  54
VAL A 121
None
1.07A 4l4gA-4qaeA:
undetectable
4l4gA-4qaeA:
16.99
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.
4txd CSC2

(Thermofilum
pendens)
no annotation 4 THR A  85
LEU A 249
VAL A  43
VAL A  39
None
1.05A 4l4gA-4txdA:
undetectable
4l4gA-4txdA:
20.05
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.
4txd CSC2

(Thermofilum
pendens)
no annotation 4 THR A  85
LEU A 249
VAL A 264
VAL A  39
None
0.86A 4l4gA-4txdA:
undetectable
4l4gA-4txdA:
20.05
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.
4wy8 ESTERASE

(Rhizomucor
miehei)
PF07859
(Abhydrolase_3)
4 PHE A 128
TYR A 225
LEU A 169
VAL A 172
None
1.02A 4l4gA-4wy8A:
undetectable
4l4gA-4wy8A:
22.33
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.
4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2


(Vibrio cholerae)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 THR A 124
LEU A 167
VAL A 165
VAL A 308
None
1.07A 4l4gA-4x0oA:
undetectable
4l4gA-4x0oA:
22.41
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.
4xxw PROTOCADHERIN-15

(Mus musculus)
no annotation 5 PHE B 183
TYR B 207
LEU B 234
VAL B 135
VAL B 141
None
1.32A 4l4gA-4xxwB:
undetectable
4l4gA-4xxwB:
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.
4y96 TRIOSEPHOSPHATE
ISOMERASE


(Gemmata
obscuriglobus)
PF00121
(TIM)
4 PHE A 163
TYR A 202
VAL A 151
VAL A 117
None
0.96A 4l4gA-4y96A:
undetectable
4l4gA-4y96A:
22.67
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.
4ypv EST8

(Parvibaculum)
PF07859
(Abhydrolase_3)
4 PHE A 125
TYR A 220
LEU A 164
VAL A 167
None
1.05A 4l4gA-4ypvA:
undetectable
4l4gA-4ypvA:
24.44
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.
4z8t AVRRXO1-ORF1

(Xanthomonas
oryzae)
no annotation 4 THR A 184
LEU A 142
VAL A 243
VAL A 194
None
0.94A 4l4gA-4z8tA:
undetectable
4l4gA-4z8tA:
22.32
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.
5ah4 DNA POLYMERASE III
SUBUNIT BETA


(Mycolicibacterium
smegmatis)
PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3)
4 THR A  88
LEU A  84
VAL A  43
VAL A  67
None
0.96A 4l4gA-5ah4A:
undetectable
4l4gA-5ah4A:
24.57
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.
5b71 SKY59 FAB HEAVY
CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 TYR B  33
THR B  28
VAL B   2
ASP B 104
None
0.93A 4l4gA-5b71B:
undetectable
4l4gA-5b71B:
17.59
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.
5cay ENVELOPE
GLYCOPROTEIN GP120
CORE FROM ST STRAIN
OF HIV-2


(Human
immunodeficiency
virus 2)
PF00516
(GP120)
4 PHE G 482
LEU G 301
VAL G 357
VAL G 412
None
1.04A 4l4gA-5cayG:
undetectable
4l4gA-5cayG:
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.
5d7z LACTOYLGLUTATHIONE
LYASE


(Zea mays)
PF00903
(Glyoxalase)
4 PHE A 143
LEU A  66
VAL A  77
ASP A 137
None
1.04A 4l4gA-5d7zA:
undetectable
4l4gA-5d7zA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dql ISOCITRATE LYASE 1

(Mycobacterium
tuberculosis)
PF00463
(ICL)
4 THR A 389
VAL A  78
VAL A 143
ASP A 140
None
1.00A 4l4gA-5dqlA:
undetectable
4l4gA-5dqlA:
22.68
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.
5f5v PRP38

(Chaetomium
thermophilum)
PF03371
(PRP38)
4 TYR A 105
LEU A 119
VAL A  65
VAL A  56
None
0.94A 4l4gA-5f5vA:
undetectable
4l4gA-5f5vA:
21.65
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.
5gje LOW-DENSITY
LIPOPROTEIN
RECEPTOR-RELATED
PROTEIN 6


(Homo sapiens)
PF00058
(Ldl_recept_b)
PF14670
(FXa_inhibition)
4 THR B 812
LEU B 814
VAL B 827
VAL B 787
None
1.06A 4l4gA-5gjeB:
undetectable
4l4gA-5gjeB:
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.
5gte LACHRYMATORY-FACTOR
SYNTHASE


(Allium cepa)
PF10604
(Polyketide_cyc2)
4 PHE A 104
TYR A 114
LEU A 152
VAL A  73
None
0.91A 4l4gA-5gteA:
undetectable
4l4gA-5gteA:
16.11
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.
5k53 ALDEHYDE
DEFORMYLATING
OXYGENASE


(Oscillatoria
sp.)
PF11266
(Ald_deCOase)
4 TYR A  17
LEU A  74
VAL A  76
VAL A  28
None
None
None
STE  A 502 ( 4.8A)
1.04A 4l4gA-5k53A:
undetectable
4l4gA-5k53A:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lad PUTATIVE GTP-BINDING
PROTEIN


(Thermotoga
maritima)
PF01926
(MMR_HSR1)
4 TYR A 139
THR A  96
LEU A  94
VAL A 108
None
1.05A 4l4gA-5ladA:
undetectable
4l4gA-5ladA:
21.27
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.
5ldd MON1
CCZ1


(Chaetomium
thermophilum;
Chaetomium
thermophilum)
PF03164
(Mon1)
PF08217
(DUF1712)
4 PHE B 114
LEU A 226
VAL A 287
VAL A 274
None
0.99A 4l4gA-5lddB:
undetectable
4l4gA-5lddB:
22.30
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.
5lmx DNA-DIRECTED RNA
POLYMERASES I AND
III SUBUNIT
RPAC1,DNA-DIRECTED
RNA POLYMERASES I
AND III SUBUNIT
RPAC1


(Saccharomyces
cerevisiae)
PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L)
4 PHE C 251
LEU C 280
VAL C 289
ASP C 273
PHE  C 251 ( 1.3A)
LEU  C 280 ( 0.5A)
VAL  C 289 ( 0.5A)
ASP  C 273 ( 0.6A)
0.97A 4l4gA-5lmxC:
undetectable
4l4gA-5lmxC:
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.
5lq3 CMEB

(Campylobacter
jejuni)
PF00873
(ACR_tran)
4 THR A 845
LEU A 846
VAL A 679
VAL A 710
None
0.98A 4l4gA-5lq3A:
undetectable
4l4gA-5lq3A:
16.25
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.
5mz9 -

(-)
no annotation 4 TYR A 322
THR A 343
VAL A 547
VAL A 543
None
1.03A 4l4gA-5mz9A:
undetectable
4l4gA-5mz9A:
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.
5n48 NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN


(Homo sapiens)
no annotation 4 PHE A  83
TYR A  56
THR A  54
VAL A 121
None
0.97A 4l4gA-5n48A:
undetectable
4l4gA-5n48A:
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.
5sy7 NEURONAL PAS
DOMAIN-CONTAINING
PROTEIN 3


(Mus musculus)
PF00010
(HLH)
PF00989
(PAS)
PF08447
(PAS_3)
4 PHE B 176
LEU B 187
VAL B 183
VAL B 318
None
1.03A 4l4gA-5sy7B:
undetectable
4l4gA-5sy7B:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w8u ORF1AB PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus)
PF08715
(Viral_protease)
4 TYR A  26
LEU A  54
VAL A   6
ASP A  46
None
0.95A 4l4gA-5w8uA:
undetectable
4l4gA-5w8uA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wrr PSEUDOKINASE FAM20A

(Homo sapiens)
PF06702
(Fam20C)
4 PHE A  96
TYR A 101
LEU A 466
VAL A 476
None
1.06A 4l4gA-5wrrA:
undetectable
4l4gA-5wrrA:
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.
5x2g CRISPR-ASSOCIATED
ENDONUCLEASE CAS9


(Campylobacter
jejuni)
no annotation 4 PHE A   7
TYR A 459
THR A 651
LEU A 435
None
0.94A 4l4gA-5x2gA:
undetectable
4l4gA-5x2gA:
19.64
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.
6ffl MALTOSE/MALTODEXTRIN
TRANSPORT PERMEASE
HOMOLOGUE


(Bdellovibrio
bacteriovorus)
no annotation 4 PHE A  90
TYR A  89
THR A 295
LEU A 291
None
1.02A 4l4gA-6fflA:
undetectable
4l4gA-6fflA:
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.
6gh2 LAMINARIBIOSE
PHOSPHORYLASE


(Paenibacillus
sp. YM1)
no annotation 4 THR A 805
LEU A 761
VAL A 760
VAL A 676
None
1.02A 4l4gA-6gh2A:
undetectable
4l4gA-6gh2A:
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.
6gqz -

(-)
no annotation 4 PHE A  83
TYR A  56
THR A  54
VAL A 121
None
1.01A 4l4gA-6gqzA:
undetectable
4l4gA-6gqzA:
undetectable