SIMILAR PATTERNS OF AMINO ACIDS FOR 3QF1_A_PZEA6951

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.
1aoc COAGULOGEN

(Tachypleus
tridentatus)
PF02035
(Coagulin)
3 HIS A 125
ARG A  74
GLU A  71
None
1.12A 3qf1A-1aocA:
undetectable
3qf1A-1aocA:
14.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens)
PF03098
(An_peroxidase)
3 HIS A  95
ARG C 239
GLU C 242
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
0.43A 3qf1A-1d7wA:
undetectable
3qf1A-1d7wA:
38.17
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.
1h88 MYB PROTO-ONCOGENE
PROTEIN


(Mus musculus)
PF00249
(Myb_DNA-binding)
3 HIS C 137
ARG C 133
GLU C 132
None
0.94A 3qf1A-1h88C:
undetectable
3qf1A-1h88C:
12.74
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.
1ik6 PYRUVATE
DEHYDROGENASE


(Pyrobaculum
aerophilum)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
3 HIS A  19
ARG A  51
GLU A  50
None
0.76A 3qf1A-1ik6A:
0.2
3qf1A-1ik6A:
20.87
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
3 HIS A 414
ARG A 178
GLU A 368
None
1.04A 3qf1A-1knrA:
0.0
3qf1A-1knrA:
23.18
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.
1kyi ATP-DEPENDENT HSL
PROTEASE ATP-BINDING
SUBUNIT HSLU


(Haemophilus
influenzae)
PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
3 HIS A  16
ARG A  69
GLU A  12
None
0.86A 3qf1A-1kyiA:
0.0
3qf1A-1kyiA:
21.67
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.
1ltd FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae)
PF00173
(Cyt-b5)
PF01070
(FMN_dh)
3 HIS A 154
ARG A 433
GLU A 129
None
FMN  A 570 (-3.8A)
None
1.14A 3qf1A-1ltdA:
0.0
3qf1A-1ltdA:
21.43
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.
1miu BREAST CANCER TYPE 2
SUSCEPTIBILITY
PROTEIN


(Mus musculus)
PF09103
(BRCA-2_OB1)
PF09104
(BRCA-2_OB3)
PF09121
(Tower)
PF09169
(BRCA-2_helical)
3 HIS A2544
ARG A2580
GLU A2584
None
0.98A 3qf1A-1miuA:
0.0
3qf1A-1miuA:
22.57
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.
1ofh ATP-DEPENDENT HSL
PROTEASE ATP-BINDING
SUBUNIT HSLU


(Haemophilus
influenzae)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
3 HIS A  16
ARG A  69
GLU A  12
None
0.86A 3qf1A-1ofhA:
0.0
3qf1A-1ofhA:
18.18
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.
1qcw FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae)
PF01070
(FMN_dh)
3 HIS A 154
ARG A 433
GLU A 129
None
FNS  A 570 (-4.1A)
None
1.14A 3qf1A-1qcwA:
0.0
3qf1A-1qcwA:
21.45
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.
1ryy ALPHA-AMINO ACID
ESTER HYDROLASE


(Acetobacter
pasteurianus)
PF02129
(Peptidase_S15)
PF08530
(PepX_C)
3 HIS A 391
ARG A 395
GLU A 140
None
1.18A 3qf1A-1ryyA:
undetectable
3qf1A-1ryyA:
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.
1tc5 PROBABLE EUKARYOTIC
D-AMINO ACID TRNA
DEACYLASE,
LMAJ005534AAA


(Leishmania
major)
PF02580
(Tyr_Deacylase)
3 HIS A  22
ARG A 181
GLU A 183
None
0.89A 3qf1A-1tc5A:
undetectable
3qf1A-1tc5A:
14.63
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.
1u6g TIP120 PROTEIN

(Homo sapiens)
PF08623
(TIP120)
3 HIS C 848
ARG C 808
GLU C 844
None
0.93A 3qf1A-1u6gC:
undetectable
3qf1A-1u6gC:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN


(Aquifex
aeolicus)
PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
3 HIS A 296
ARG A  16
GLU A  12
None
1.18A 3qf1A-1ulzA:
undetectable
3qf1A-1ulzA:
22.44
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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN


(Escherichia
coli)
PF04257
(Exonuc_V_gamma)
3 HIS C 784
ARG C 799
GLU C 798
None
1.19A 3qf1A-1w36C:
undetectable
3qf1A-1w36C:
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.
1x2l HOMEOBOX PROTEIN
CUX-2


(Homo sapiens)
PF02376
(CUT)
3 HIS A  33
ARG A  90
GLU A  83
None
1.02A 3qf1A-1x2lA:
undetectable
3qf1A-1x2lA:
11.45
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.
1xhb POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 1


(Mus musculus)
PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin)
3 HIS A 125
ARG A 186
GLU A 159
None
1.07A 3qf1A-1xhbA:
undetectable
3qf1A-1xhbA:
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.
1z54 PROBABLE
THIOESTERASE


(Thermus
thermophilus)
PF03061
(4HBT)
3 HIS A  45
ARG A  46
GLU A  38
None
1.07A 3qf1A-1z54A:
undetectable
3qf1A-1z54A:
12.73
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.
2bre ATP-DEPENDENT
MOLECULAR CHAPERONE
HSP82


(Saccharomyces
cerevisiae)
PF00183
(HSP90)
PF02518
(HATPase_c)
3 HIS A 197
ARG A  32
GLU A  28
None
0.91A 3qf1A-2breA:
undetectable
3qf1A-2breA:
16.44
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.
2cu5 CONSERVED
HYPOTHETICAL PROTEIN
TT1486


(Thermus
thermophilus)
PF01894
(UPF0047)
3 HIS A  40
ARG A 122
GLU A 123
None
0.88A 3qf1A-2cu5A:
undetectable
3qf1A-2cu5A:
14.09
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.
2dig LAMIN-B RECEPTOR

(Homo sapiens)
PF09465
(LBR_tudor)
3 HIS A  37
ARG A  11
GLU A  58
None
1.05A 3qf1A-2digA:
undetectable
3qf1A-2digA:
8.65
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.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
3 HIS A 112
ARG A 100
GLU A 102
None
None
CL  A2001 ( 4.6A)
0.55A 3qf1A-2e5vA:
undetectable
3qf1A-2e5vA:
24.64
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.
2e6k TRANSKETOLASE

(Thermus
thermophilus)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
3 HIS A 295
ARG A  46
GLU A   8
None
1.15A 3qf1A-2e6kA:
0.0
3qf1A-2e6kA:
22.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gjm LACTOPEROXIDASE

(Bubalus bubalis)
PF03098
(An_peroxidase)
3 HIS A  95
ARG A 239
GLU A 242
SCN  A1502 ( 4.8A)
HEM  A 605 (-4.7A)
HEM  A 605 ( 2.2A)
0.45A 3qf1A-2gjmA:
60.5
3qf1A-2gjmA:
95.54
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.
2id0 EXORIBONUCLEASE 2

(Escherichia
coli)
PF00575
(S1)
PF00773
(RNB)
PF08206
(OB_RNB)
3 HIS A 157
ARG A 552
GLU A 373
None
0.97A 3qf1A-2id0A:
undetectable
3qf1A-2id0A:
23.12
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.
2nef NEGATIVE FACTOR
(F-PROTEIN)


(Human
immunodeficiency
virus 1)
PF00469
(F-protein)
3 HIS A 193
ARG A 196
GLU A 197
None
1.16A 3qf1A-2nefA:
undetectable
3qf1A-2nefA:
14.04
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.
2nql ISOMERASE/LACTONIZIN
G ENZYME


(Agrobacterium
fabrum)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 HIS A 366
ARG A 361
GLU A 362
None
1.17A 3qf1A-2nqlA:
undetectable
3qf1A-2nqlA:
22.15
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.
2ols PHOSPHOENOLPYRUVATE
SYNTHASE


(Neisseria
meningitidis)
PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C)
3 HIS A 759
ARG A 727
GLU A 726
None
1.14A 3qf1A-2olsA:
undetectable
3qf1A-2olsA:
23.33
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.
2q7s N-FORMYLGLUTAMATE
AMIDOHYDROLASE


(Cupriavidus
pinatubonensis)
PF05013
(FGase)
3 HIS A  56
ARG A 263
GLU A 262
None
1.15A 3qf1A-2q7sA:
undetectable
3qf1A-2q7sA:
17.86
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.
2qlw RHAU

(Rhizobium
leguminosarum)
PF05336
(rhaM)
3 HIS A  81
ARG A  23
GLU A  26
None
1.15A 3qf1A-2qlwA:
undetectable
3qf1A-2qlwA:
11.88
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.
2qlx L-RHAMNOSE
MUTAROTASE


(Rhizobium
leguminosarum)
PF05336
(rhaM)
3 HIS A  81
ARG A  23
GLU A  26
None
1.16A 3qf1A-2qlxA:
undetectable
3qf1A-2qlxA:
10.64
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.
2rea PHOSPHATIDYLINOSITOL
-4-PHOSPHATE
3-KINASE C2
DOMAIN-CONTAINING
ALPHA POLYPEPTIDE


(Homo sapiens)
PF00787
(PX)
3 HIS A1536
ARG A1461
GLU A1468
None
1.08A 3qf1A-2reaA:
undetectable
3qf1A-2reaA:
10.07
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN


(Azospirillum
brasilense)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
3 HIS A 971
ARG A 914
GLU A 886
None
None
AKG  A2475 (-4.2A)
1.15A 3qf1A-2vdcA:
undetectable
3qf1A-2vdcA:
18.61
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.
2x98 ALKALINE PHOSPHATASE

(Halobacterium
salinarum)
PF00245
(Alk_phosphatase)
3 HIS A 305
ARG A 302
GLU A 299
None
None
MG  A1477 (-2.6A)
0.91A 3qf1A-2x98A:
undetectable
3qf1A-2x98A:
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.
2xgt ASPARAGINYL-TRNA
SYNTHETASE,
CYTOPLASMIC


(Brugia malayi)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
3 HIS A 134
ARG A 149
GLU A 239
None
1.18A 3qf1A-2xgtA:
undetectable
3qf1A-2xgtA:
22.24
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.
2xhe UNC18

(Monosiga
brevicollis)
PF00995
(Sec1)
3 HIS A 163
ARG A 166
GLU A  74
None
1.18A 3qf1A-2xheA:
undetectable
3qf1A-2xheA:
21.94
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.
2yjg LACTATE RACEMASE
APOPROTEIN


(Thermoanaerobacterium
thermosaccharolyticum)
PF09861
(DUF2088)
3 HIS A 221
ARG A 183
GLU A 256
None
0.92A 3qf1A-2yjgA:
undetectable
3qf1A-2yjgA:
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.
3c2u XYLOSIDASE/ARABINOSI
DASE


(Selenomonas
ruminantium)
PF04616
(Glyco_hydro_43)
PF07081
(DUF1349)
3 HIS A 355
ARG A 371
GLU A 372
None
0.82A 3qf1A-3c2uA:
undetectable
3qf1A-3c2uA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3crj TRANSCRIPTION
REGULATOR


(Haloarcula
marismortui)
PF00440
(TetR_N)
PF13977
(TetR_C_6)
3 HIS A  27
ARG A  36
GLU A  40
None
0.97A 3qf1A-3crjA:
undetectable
3qf1A-3crjA:
15.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3din PREPROTEIN
TRANSLOCASE SUBUNIT
SECG
PREPROTEIN
TRANSLOCASE SUBUNIT
SECY


(Thermotoga
maritima;
Thermotoga sp.
RQ2)
PF00344
(SecY)
PF03840
(SecG)
3 HIS E  40
ARG C 113
GLU C 110
None
0.92A 3qf1A-3dinE:
undetectable
3qf1A-3dinE:
8.60
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.
3ec7 PUTATIVE
DEHYDROGENASE


(Salmonella
enterica)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
3 HIS A  17
ARG A  20
GLU A 282
None
1.03A 3qf1A-3ec7A:
undetectable
3qf1A-3ec7A:
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.
3g3s GCN5-RELATED
N-ACETYLTRANSFERASE


(Streptococcus
suis)
PF12746
(GNAT_acetyltran)
3 HIS A 223
ARG A  98
GLU A 246
None
EDO  A 252 (-3.7A)
None
1.01A 3qf1A-3g3sA:
undetectable
3qf1A-3g3sA:
16.78
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.
3hcy PUTATIVE
TWO-COMPONENT SENSOR
HISTIDINE KINASE
PROTEIN


(Sinorhizobium
meliloti)
PF13185
(GAF_2)
3 HIS A 113
ARG A 114
GLU A 119
None
1.08A 3qf1A-3hcyA:
undetectable
3qf1A-3hcyA:
13.76
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.
3hdp GLYOXALASE-I

(Clostridium
acetobutylicum)
PF13669
(Glyoxalase_4)
3 HIS A   4
ARG A  50
GLU A  52
None
None
NI  A 129 (-2.6A)
0.81A 3qf1A-3hdpA:
undetectable
3qf1A-3hdpA:
15.68
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.
3icx PRE MRNA SPLICING
PROTEIN


(Sulfolobus
solfataricus)
PF01798
(Nop)
3 HIS A 179
ARG A 162
GLU A 159
None
1.16A 3qf1A-3icxA:
undetectable
3qf1A-3icxA:
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.
3l4i HEAT SHOCK 70
(HSP70) PROTEIN


(Cryptosporidium
parvum)
PF00012
(HSP70)
3 HIS A 349
ARG A 209
GLU A 208
None
1.03A 3qf1A-3l4iA:
undetectable
3qf1A-3l4iA:
19.74
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.
3l7g XAA-PRO DIPEPTIDASE

(Alteromonas sp.)
PF00557
(Peptidase_M24)
3 HIS A 156
ARG A  18
GLU A  21
None
1.00A 3qf1A-3l7gA:
undetectable
3qf1A-3l7gA:
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.
3li9 HYPOTHETICAL SENSORY
TRANSDUCTION
HISTIDINE KINASE


(Methanosarcina
mazei)
PF02743
(dCache_1)
3 HIS A 126
ARG A  84
GLU A  85
None
0.97A 3qf1A-3li9A:
undetectable
3qf1A-3li9A:
17.56
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.
3mtj HOMOSERINE
DEHYDROGENASE


(Thiobacillus
denitrificans)
PF00742
(Homoserine_dh)
PF01842
(ACT)
PF03447
(NAD_binding_3)
3 HIS A 263
ARG A 430
GLU A 432
None
0.97A 3qf1A-3mtjA:
undetectable
3qf1A-3mtjA:
22.44
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR


(Ruegeria sp.
TM1040)
PF03070
(TENA_THI-4)
3 HIS A  25
ARG A 150
GLU A 146
None
1.05A 3qf1A-3mvuA:
1.4
3qf1A-3mvuA:
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.
3r5z PUTATIVE
UNCHARACTERIZED
PROTEIN


(Nocardia
farcinica)
PF04075
(F420H2_quin_red)
3 HIS A  77
ARG A 134
GLU A 135
None
0.85A 3qf1A-3r5zA:
undetectable
3qf1A-3r5zA:
13.24
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.
3s52 PUTATIVE
FUMARYLACETOACETATE
HYDROLASE FAMILY
PROTEIN


(Yersinia pestis)
PF01557
(FAA_hydrolase)
3 HIS A  68
ARG A 105
GLU A 106
None
0.94A 3qf1A-3s52A:
undetectable
3qf1A-3s52A:
16.83
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.
3u4y UNCHARACTERIZED
PROTEIN


(Desulfotomaculum
acetoxidans)
PF10282
(Lactonase)
3 HIS A  15
ARG A 292
GLU A  13
None
1.18A 3qf1A-3u4yA:
undetectable
3qf1A-3u4yA:
19.87
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.
3u7b ENDO-1,4-BETA-XYLANA
SE


(Fusarium
oxysporum)
PF00331
(Glyco_hydro_10)
3 HIS A 125
ARG A  80
GLU A  78
None
0.96A 3qf1A-3u7bA:
undetectable
3qf1A-3u7bA:
19.87
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis)
PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
3 HIS A 919
ARG A 638
GLU A 634
None
1.15A 3qf1A-3va7A:
undetectable
3qf1A-3va7A:
19.57
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.
3ve5 RECOMBINATION
PROTEIN RECR


(Caldanaerobacter
subterraneus)
no annotation 3 HIS D 103
ARG D 128
GLU D 124
None
1.06A 3qf1A-3ve5D:
undetectable
3qf1A-3ve5D:
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.
3vpc PUTATIVE
ACETYLORNITHINE
DEACETYLASE


(Sulfurisphaera
tokodaii)
PF08443
(RimK)
3 HIS A 164
ARG A 153
GLU A 154
None
0.99A 3qf1A-3vpcA:
undetectable
3qf1A-3vpcA:
18.39
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.
3wuc GALECTIN

(Xenopus laevis)
PF00337
(Gal-bind_lectin)
3 HIS A 135
ARG A  19
GLU A  21
None
1.01A 3qf1A-3wucA:
undetectable
3qf1A-3wucA:
12.64
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.
3zqc MYB3

(Trichomonas
vaginalis)
PF00249
(Myb_DNA-binding)
3 HIS A  98
ARG A  94
GLU A  93
None
1.11A 3qf1A-3zqcA:
undetectable
3qf1A-3zqcA:
12.46
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.
4by6 GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 1


(Saccharomyces
cerevisiae)
PF04054
(Not1)
3 HIS A1828
ARG A1993
GLU A1990
None
1.11A 3qf1A-4by6A:
undetectable
3qf1A-4by6A:
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.
4cgr PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR


(Streptomyces
coelicolor)
PF00440
(TetR_N)
3 HIS A 114
ARG A 110
GLU A 109
PO4  A1231 (-4.0A)
PO4  A1231 (-3.7A)
None
1.18A 3qf1A-4cgrA:
undetectable
3qf1A-4cgrA:
16.30
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.
4f0e POLY [ADP-RIBOSE]
POLYMERASE 15


(Homo sapiens)
PF00644
(PARP)
3 HIS A 463
ARG A 505
GLU A 649
None
1.01A 3qf1A-4f0eA:
undetectable
3qf1A-4f0eA:
15.98
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.
4hly K9

(Human
gammaherpesvirus
8)
PF00605
(IRF)
3 HIS A 100
ARG A  48
GLU A  23
None
0.77A 3qf1A-4hlyA:
undetectable
3qf1A-4hlyA:
12.67
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.
4hv4 UDP-N-ACETYLMURAMATE
--L-ALANINE LIGASE


(Yersinia pestis)
PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M)
3 HIS A  70
ARG A  72
GLU A  94
None
0.97A 3qf1A-4hv4A:
undetectable
3qf1A-4hv4A:
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.
4j5u SERINE
HYDROXYMETHYLTRANSFE
RASE


(Rickettsia
rickettsii)
PF00464
(SHMT)
3 HIS A 383
ARG A 304
GLU A 303
None
1.13A 3qf1A-4j5uA:
undetectable
3qf1A-4j5uA:
20.89
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.
4knw N-ACYLNEURAMINATE-9-
PHOSPHATASE


(Homo sapiens)
PF13419
(HAD_2)
3 HIS A 109
ARG A  28
GLU A  32
None
1.05A 3qf1A-4knwA:
undetectable
3qf1A-4knwA:
16.36
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.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC


([Bacillus]
selenitireducens)
PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N)
3 HIS A   7
ARG A  20
GLU A  22
None
1.17A 3qf1A-4ktpA:
undetectable
3qf1A-4ktpA:
21.63
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.
4nps BARTONELLA EFFECTOR
PROTEIN (BEP)
SUBSTRATE OF VIRB
T4SS


(Bartonella
clarridgeiae)
PF02661
(Fic)
3 HIS A 168
ARG A  92
GLU A 172
None
1.19A 3qf1A-4npsA:
undetectable
3qf1A-4npsA:
22.12
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.
4p8s RETICULON-4
RECEPTOR-LIKE 2


(Rattus
norvegicus)
PF13855
(LRR_8)
3 HIS A 219
ARG A 220
GLU A 245
None
0.93A 3qf1A-4p8sA:
undetectable
3qf1A-4p8sA:
20.17
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.
4pay SIDC, INTERAPTIN

(Legionella
pneumophila)
no annotation 3 HIS A 504
ARG A  16
GLU A  15
None
1.11A 3qf1A-4payA:
0.0
3qf1A-4payA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pww OR494

(synthetic
construct)
no annotation 3 HIS A  85
ARG A  45
GLU A  43
None
0.95A 3qf1A-4pwwA:
undetectable
3qf1A-4pwwA:
9.03
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.
4ro5 SAT DOMAIN FROM CAZM

(Chaetomium
globosum)
PF16073
(SAT)
3 HIS A 382
ARG A 366
GLU A 365
None
None
GOL  A 402 (-3.7A)
1.19A 3qf1A-4ro5A:
0.0
3qf1A-4ro5A:
21.29
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.
4s0u RETINOIC ACID EARLY
TRANSCRIPT 1L
PROTEIN


(Homo sapiens)
PF00129
(MHC_I)
3 HIS C 183
ARG C 156
GLU C 154
None
0.84A 3qf1A-4s0uC:
undetectable
3qf1A-4s0uC:
14.90
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.
4yfj AMINOGLYCOSIDE
3'-N-ACETYLTRANSFERA
SE


(Pseudomonas
aeruginosa)
PF00583
(Acetyltransf_1)
3 HIS A 128
ARG A 131
GLU A 135
None
1.19A 3qf1A-4yfjA:
undetectable
3qf1A-4yfjA:
13.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z38 MLNA

(Bacillus
velezensis)
no annotation 3 HIS A 457
ARG A 424
GLU A 422
None
0.97A 3qf1A-4z38A:
undetectable
3qf1A-4z38A:
22.95
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.
5evj ARSENITE
METHYLTRANSFERASE


(Chlamydomonas
reinhardtii)
PF13847
(Methyltransf_31)
3 HIS A 196
ARG A 272
GLU A 246
None
1.17A 3qf1A-5evjA:
undetectable
3qf1A-5evjA:
21.08
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.
5fji BETA-GLUCOSIDASE

(Aspergillus
fumigatus)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like)
3 HIS A 637
ARG A 641
GLU A 643
None
1.03A 3qf1A-5fjiA:
undetectable
3qf1A-5fjiA:
21.83
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.
5gjn LYSINE/ORNITHINE
DECARBOXYLASE


(Selenomonas
ruminantium)
PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N)
3 HIS A 306
ARG A   5
GLU A 348
None
0.94A 3qf1A-5gjnA:
undetectable
3qf1A-5gjnA:
20.43
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.
5hh9 PVDN

(Pseudomonas
aeruginosa)
PF00266
(Aminotran_5)
3 HIS A 309
ARG A 314
GLU A  98
None
1.00A 3qf1A-5hh9A:
undetectable
3qf1A-5hh9A:
20.65
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.
5huq LACTATE RACEMIZATION
OPERON PROTEIN LARA


(Lactobacillus
plantarum)
PF09861
(DUF2088)
3 HIS A 221
ARG A 183
GLU A 256
None
0.70A 3qf1A-5huqA:
undetectable
3qf1A-5huqA:
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.
5i0p BETA-LACTAMASE
DOMAIN PROTEIN


(Burkholderia
ambifaria)
PF00753
(Lactamase_B)
3 HIS A 286
ARG A 290
GLU A 329
None
0.69A 3qf1A-5i0pA:
undetectable
3qf1A-5i0pA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis)
PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
3 HIS A 919
ARG A 638
GLU A 634
None
1.19A 3qf1A-5i8iA:
undetectable
3qf1A-5i8iA:
15.12
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.
5jdk SWITCH-ACTIVATING
PROTEIN 1


(Schizosaccharomyces
pombe)
no annotation 3 HIS A  49
ARG A 122
GLU A 118
None
1.11A 3qf1A-5jdkA:
undetectable
3qf1A-5jdkA:
12.79
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.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE


([Candida]
glabrata)
PF00067
(p450)
3 HIS A 470
ARG A 386
GLU A 124
HEM  A 601 (-3.6A)
HEM  A 601 (-3.0A)
None
1.18A 3qf1A-5jlcA:
undetectable
3qf1A-5jlcA:
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.
5ks8 PYRUVATE CARBOXYLASE
SUBUNIT ALPHA


(Methylobacillus
flagellatus)
PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
3 HIS A 296
ARG A  16
GLU A  12
None
1.16A 3qf1A-5ks8A:
undetectable
3qf1A-5ks8A:
20.61
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.
5l7l ELP3 FAMILY, ELP3
FAMILY


(Dehalococcoides
mccartyi)
PF04055
(Radical_SAM)
PF16199
(Radical_SAM_C)
3 HIS A 195
ARG A 155
GLU A 386
None
0.90A 3qf1A-5l7lA:
undetectable
3qf1A-5l7lA:
22.13
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.
5l83 AUTOPHAGY-RELATED
PROTEIN


(Solanum
tuberosum)
PF02991
(Atg8)
3 HIS A  10
ARG A  14
GLU A  18
None
1.10A 3qf1A-5l83A:
undetectable
3qf1A-5l83A:
11.21
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.
5m58 C-METHYLTRANSFERASE
COUO


(Streptomyces
rishiriensis)
PF13649
(Methyltransf_25)
3 HIS A 117
ARG A 116
GLU A  27
None
SAH  A 301 (-3.9A)
None
0.98A 3qf1A-5m58A:
undetectable
3qf1A-5m58A:
18.10
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.
5nmp ISATIN HYDROLASE

(Ralstonia
solanacearum)
no annotation 3 HIS A 171
ARG A 166
GLU A 167
None
0.88A 3qf1A-5nmpA:
undetectable
3qf1A-5nmpA:
9.86
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.
5oms CYTOCHROME P450

(Amycolatopsis
sp. ATCC 39116)
no annotation 3 HIS A 354
ARG A 298
GLU A  64
HEM  A 501 (-3.8A)
HEM  A 501 (-2.9A)
None
1.16A 3qf1A-5omsA:
undetectable
3qf1A-5omsA:
10.20
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.
5t0l BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Toxoplasma
gondii)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
3 HIS A 601
ARG A 566
GLU A 567
None
1.16A 3qf1A-5t0lA:
undetectable
3qf1A-5t0lA:
23.78
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.
5txv ATP-DEPENDENT
PROTEASE ATPASE
SUBUNIT HSLU


(Escherichia
coli)
PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
3 HIS A  16
ARG A  69
GLU A  12
None
0.96A 3qf1A-5txvA:
undetectable
3qf1A-5txvA:
21.75
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.
5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE


(Acinetobacter
baumannii)
PF00275
(EPSP_synthase)
3 HIS A 254
ARG A  17
GLU A  15
None
0.86A 3qf1A-5u4hA:
undetectable
3qf1A-5u4hA:
22.57
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.
5voc ENVELOPE
GLYCOPROTEIN L


(Human
betaherpesvirus
5)
PF01801
(Cytomega_gL)
3 HIS B 177
ARG B 196
GLU B 198
None
1.04A 3qf1A-5vocB:
undetectable
3qf1A-5vocB:
19.63
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.
5vzj EXOSOME COMPLEX
EXONUCLEASE RRP6


(Saccharomyces
cerevisiae)
PF00570
(HRDC)
PF01612
(DNA_pol_A_exo1)
3 HIS J 581
ARG J 578
GLU J 579
None
1.14A 3qf1A-5vzjJ:
undetectable
3qf1A-5vzjJ:
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.
5wuq ANTI-SIGMA-W FACTOR
RSIW
ECF RNA POLYMERASE
SIGMA FACTOR SIGW


(Bacillus
subtilis)
PF04542
(Sigma70_r2)
PF08281
(Sigma70_r4_2)
PF13490
(zf-HC2)
3 HIS C  12
ARG A 177
GLU A 178
None
1.12A 3qf1A-5wuqC:
undetectable
3qf1A-5wuqC:
7.93
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.
5xgu RIBONUCLEASE R

(Escherichia
coli)
no annotation 3 HIS B 479
ARG B 486
GLU B 534
None
0.91A 3qf1A-5xguB:
undetectable
3qf1A-5xguB:
24.08
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.
6b2q SERINE/THREONINE-PRO
TEIN KINASE PKNA


(Mycobacterium
tuberculosis)
no annotation 3 HIS A  77
ARG A  37
GLU A  96
None
1.15A 3qf1A-6b2qA:
undetectable
3qf1A-6b2qA:
10.59
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.
6cza -

(-)
no annotation 3 HIS B 169
ARG B 148
GLU B 147
None
1.12A 3qf1A-6czaB:
undetectable
3qf1A-6czaB:
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.
6erc PEROXINECTIN A

(Dictyostelium
discoideum)
no annotation 3 HIS A 101
ARG A 233
GLU A 236
None
HEM  A 604 (-3.1A)
HEM  A 604 (-2.2A)
0.80A 3qf1A-6ercA:
39.4
3qf1A-6ercA:
8.99