SIMILAR PATTERNS OF AMINO ACIDS FOR 1XOQ_B_ROFB501_1

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.
1bdg HEXOKINASE

(Schistosoma
mansoni)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A  43
ASN A 235
GLN A 291
None
GLC  A 501 (-3.8A)
GLC  A 501 ( 4.2A)
1.03A 1xoqB-1bdgA:
undetectable
1xoqB-1bdgA:
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.
1og6 HYPOTHETICAL
OXIDOREDUCTASE YDHF


(Escherichia
coli)
PF00248
(Aldo_ket_red)
3 MET A 134
ASN A 179
GLN A 198
None
0.95A 1xoqB-1og6A:
undetectable
1xoqB-1og6A:
23.32
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.
1rfv PYRIDOXAL KINASE

(Ovis aries)
PF08543
(Phos_pyr_kin)
3 MET A 221
ASN A 251
GLN A 205
None
0.94A 1xoqB-1rfvA:
undetectable
1xoqB-1rfvA:
22.79
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.
1tjy SUGAR TRANSPORT
PROTEIN


(Salmonella
enterica)
PF13407
(Peripla_BP_4)
3 MET A 139
ASN A 129
GLN A 271
None
0.88A 1xoqB-1tjyA:
undetectable
1xoqB-1tjyA:
21.09
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.
1uc4 DIOL DEHYDRASE ALPHA
SUBUNIT


(Klebsiella
oxytoca)
PF02286
(Dehydratase_LU)
3 MET A 129
ASN A 334
GLN A 140
None
0.90A 1xoqB-1uc4A:
undetectable
1xoqB-1uc4A:
20.58
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.
1uli BIPHENYL DIOXYGENASE
LARGE SUBUNIT
BIPHENYL DIOXYGENASE
SMALL SUBUNIT


(Rhodococcus
jostii;
Rhodococcus
jostii)
PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B)
3 MET A  82
ASN A 112
GLN B  70
None
1.01A 1xoqB-1uliA:
undetectable
1xoqB-1uliA:
21.41
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.
1v6c ALKALINE SERINE
PROTEASE


(Pseudoalteromonas
sp. AS-11)
PF00082
(Peptidase_S8)
PF02225
(PA)
3 MET A 370
ASN A 235
GLN A 285
None
1.05A 1xoqB-1v6cA:
undetectable
1xoqB-1v6cA:
21.13
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.
1ve1 O-ACETYLSERINE
SULFHYDRYLASE


(Thermus
thermophilus)
PF00291
(PALP)
3 MET A  96
ASN A  72
GLN A 141
None
PLP  A 413 (-3.6A)
None
0.73A 1xoqB-1ve1A:
undetectable
1xoqB-1ve1A:
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.
2b5y YKUV PROTEIN

(Bacillus
subtilis)
PF00578
(AhpC-TSA)
3 MET A 133
ASN A  52
GLN A  92
None
0.89A 1xoqB-2b5yA:
undetectable
1xoqB-2b5yA:
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.
2cqg TAR DNA-BINDING
PROTEIN-43


(Homo sapiens)
PF00076
(RRM_1)
3 MET A 162
ASN A 179
GLN A 182
None
1.01A 1xoqB-2cqgA:
undetectable
1xoqB-2cqgA:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e28 PYRUVATE KINASE

(Geobacillus
stearothermophilus)
PF00224
(PK)
PF00391
(PEP-utilizers)
PF02887
(PK_C)
3 MET A 329
ASN A 301
GLN A 261
None
1.05A 1xoqB-2e28A:
undetectable
1xoqB-2e28A:
19.83
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.
2hi8 SULFATASE-MODIFYING
FACTOR 1


(Homo sapiens)
PF03781
(FGE-sulfatase)
3 MET X 161
ASN X 259
GLN X 262
None
CA  X1017 (-3.3A)
CA  X1017 (-4.1A)
0.93A 1xoqB-2hi8X:
undetectable
1xoqB-2hi8X:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jep XYLOGLUCANASE

(Paenibacillus
pabuli)
PF00150
(Cellulase)
3 MET A 180
ASN A 146
GLN A 150
None
1.05A 1xoqB-2jepA:
undetectable
1xoqB-2jepA:
21.39
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.
2nzt HEXOKINASE-2

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A 491
ASN A 683
GLN A 739
None
GLC  A1003 (-3.6A)
GLC  A1003 (-4.3A)
0.82A 1xoqB-2nztA:
undetectable
1xoqB-2nztA:
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.
2qjp CYTOCHROME B

(Rhodobacter
sphaeroides)
PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B)
3 MET A  84
ASN A  99
GLN A  58
None
None
HEM  A 502 (-4.2A)
1.03A 1xoqB-2qjpA:
undetectable
1xoqB-2qjpA:
21.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qyk CYCLIC AMP-SPECIFIC
PHOSPHODIESTERASE
HSPDE4A10


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 485
ASN A 533
GLN A 581
None
NPV  A   3 (-4.4A)
NPV  A   3 (-3.1A)
0.32A 1xoqB-2qykA:
51.9
1xoqB-2qykA:
82.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2r8q CLASS I
PHOSPHODIESTERASE
PDEB1


(Leishmania
major)
PF00233
(PDEase_I)
3 MET A 797
ASN A 838
GLN A 887
None
IBM  A   3 (-4.5A)
IBM  A   3 (-3.3A)
0.58A 1xoqB-2r8qA:
39.4
1xoqB-2r8qA:
30.27
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.
2vzn VENOM ALLERGEN 3

(Solenopsis
invicta)
PF00188
(CAP)
3 MET A 131
ASN A  35
GLN A  90
None
0.81A 1xoqB-2vznA:
undetectable
1xoqB-2vznA:
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.
2xa7 AP-2 COMPLEX SUBUNIT
BETA


(Homo sapiens)
PF01602
(Adaptin_N)
3 MET B 110
ASN B  89
GLN B  59
None
1.00A 1xoqB-2xa7B:
undetectable
1xoqB-2xa7B:
19.22
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.
2yiu CYTOCHROME B

(Paracoccus
denitrificans)
PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B)
3 MET A  84
ASN A  99
GLN A  58
None
None
HEM  A 500 (-4.4A)
0.95A 1xoqB-2yiuA:
undetectable
1xoqB-2yiuA:
21.87
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.
3bwu OUTER MEMBRANE USHER
PROTEIN FIMD,
N-TERMINAL DOMAIN


(Escherichia
coli)
PF13954
(PapC_N)
3 MET D  44
ASN D 122
GLN D 117
None
0.92A 1xoqB-3bwuD:
undetectable
1xoqB-3bwuD:
16.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT


(Methanosarcina
barkeri)
PF03063
(Prismane)
3 MET A 168
ASN A 251
GLN A 322
None
0.82A 1xoqB-3cf4A:
undetectable
1xoqB-3cf4A:
16.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ecn HIGH AFFINITY
CAMP-SPECIFIC AND
IBMX-INSENSITIVE
3',5'-CYCLIC
PHOSPHODIESTERASE 8A


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 670
ASN A 729
GLN A 778
IBM  A   3 (-4.5A)
None
IBM  A   3 (-3.4A)
0.34A 1xoqB-3ecnA:
45.0
1xoqB-3ecnA:
33.42
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.
3eoe PYRUVATE KINASE

(Toxoplasma
gondii)
PF00224
(PK)
PF02887
(PK_C)
3 MET A 363
ASN A 335
GLN A 295
None
1.03A 1xoqB-3eoeA:
undetectable
1xoqB-3eoeA:
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.
3fhx PYRIDOXAL KINASE

(Homo sapiens)
PF08543
(Phos_pyr_kin)
3 MET A 221
ASN A 251
GLN A 205
None
0.97A 1xoqB-3fhxA:
undetectable
1xoqB-3fhxA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fy6 INTEGRON CASSETTE
PROTEIN


(Vibrio cholerae)
no annotation 3 MET A  28
ASN A  71
GLN A  55
None
0.91A 1xoqB-3fy6A:
undetectable
1xoqB-3fy6A:
17.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3g4g CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 439
ASN A 487
GLN A 535
D71  A 901 ( 4.0A)
D71  A 901 (-4.5A)
D71  A 901 (-3.1A)
0.58A 1xoqB-3g4gA:
52.7
1xoqB-3g4gA:
81.20
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.
3h1v GLUCOKINASE

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET X  37
ASN X 231
GLN X 287
None
GLC  X 500 (-3.8A)
GLC  X 500 (-4.2A)
0.90A 1xoqB-3h1vX:
undetectable
1xoqB-3h1vX:
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.
3hhs PHENOLOXIDASE
SUBUNIT 2


(Manduca sexta)
PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C)
3 MET A 673
ASN A 663
GLN A 527
None
1.06A 1xoqB-3hhsA:
undetectable
1xoqB-3hhsA:
20.51
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A'
DNA-DIRECTED RNA
POLYMERASE SUBUNIT B


(Sulfolobus
solfataricus;
Sulfolobus
solfataricus)
PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
3 MET A 646
ASN A 739
GLN B 662
None
1.05A 1xoqB-3hkzA:
undetectable
1xoqB-3hkzA:
17.53
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.
3hm8 HEXOKINASE-3

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A 504
ASN A 689
GLN A 745
None
GLC  A1001 (-3.8A)
GLC  A1001 (-3.8A)
0.93A 1xoqB-3hm8A:
undetectable
1xoqB-3hm8A:
23.13
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.
3ju7 PUTATIVE
PLP-DEPENDENT
AMINOTRANSFERASE


(Bacillus cereus)
PF01041
(DegT_DnrJ_EryC1)
3 MET A 246
ASN A  51
GLN A 176
None
1.00A 1xoqB-3ju7A:
undetectable
1xoqB-3ju7A:
21.04
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.
3kv0 HET-C2

(Podospora
anserina)
PF08718
(GLTP)
3 MET A  51
ASN A 124
GLN A 180
None
1.06A 1xoqB-3kv0A:
undetectable
1xoqB-3kv0A:
20.74
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.
3kwp PREDICTED
METHYLTRANSFERASE


(Lactobacillus
brevis)
PF00590
(TP_methylase)
3 MET A  28
ASN A  49
GLN A  63
None
1.04A 1xoqB-3kwpA:
undetectable
1xoqB-3kwpA:
21.88
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.
3lw2 PLASMINOGEN
ACTIVATOR INHIBITOR
1


(Mus musculus)
PF00079
(Serpin)
3 MET A  62
ASN A 167
GLN A 322
None
1.02A 1xoqB-3lw2A:
undetectable
1xoqB-3lw2A:
23.68
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.
3ml0 PENICILLIN G
ACYLASE, BETA
SUBUNIT


(Alcaligenes
faecalis)
PF01804
(Penicil_amidase)
3 MET B 320
ASN B 335
GLN B 331
None
0.91A 1xoqB-3ml0B:
undetectable
1xoqB-3ml0B:
20.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n3z HIGH AFFINITY
CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 9A


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 365
ASN A 405
GLN A 453
None
IBM  A   1 (-3.5A)
IBM  A   1 (-3.5A)
0.88A 1xoqB-3n3zA:
41.3
1xoqB-3n3zA:
30.60
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.
3o1h PERIPLASMIC PROTEIN
TORT


(Vibrio
parahaemolyticus)
PF00532
(Peripla_BP_1)
3 MET B  52
ASN B 120
GLN B  77
None
TMO  B   1 ( 4.5A)
None
0.96A 1xoqB-3o1hB:
undetectable
1xoqB-3o1hB:
26.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o57 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 347
ASN A 395
GLN A 443
ZG2  A 506 (-3.9A)
ZG2  A 506 (-4.3A)
ZG2  A 506 (-3.3A)
0.29A 1xoqB-3o57A:
51.8
1xoqB-3o57A:
82.81
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.
3ono RIBOSE/GALACTOSE
ISOMERASE


(Vibrio
parahaemolyticus)
PF02502
(LacAB_rpiB)
PF12408
(DUF3666)
3 MET A   1
ASN A 106
GLN A 103
None
0.98A 1xoqB-3onoA:
undetectable
1xoqB-3onoA:
22.94
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.
3q9o EXOTOXIN A

(Vibrio cholerae)
PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target)
3 MET A  46
ASN A 164
GLN A  26
None
1.04A 1xoqB-3q9oA:
undetectable
1xoqB-3q9oA:
21.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3sl5 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 273
ASN A 321
GLN A 369
MET  A 273 (-0.0A)
ASN  A 321 (-0.6A)
GLN  A 369 (-0.6A)
0.31A 1xoqB-3sl5A:
53.4
1xoqB-3sl5A:
94.56
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.
3snx PUTATIVE SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN


(Bacteroides
thetaiotaomicron)
PF07980
(SusD_RagB)
PF14322
(SusD-like_3)
3 MET A 356
ASN A 222
GLN A 204
None
0.89A 1xoqB-3snxA:
undetectable
1xoqB-3snxA:
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.
3swh PROTEIN UNC-13
HOMOLOG A


(Rattus
norvegicus)
PF10540
(Membr_traf_MHD)
3 MET A1231
ASN A1210
GLN A1208
None
0.94A 1xoqB-3swhA:
undetectable
1xoqB-3swhA:
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.
3t95 AUTOINDUCER
2-BINDING PROTEIN
LSRB


(Yersinia pestis)
PF13407
(Peripla_BP_4)
3 MET A 138
ASN A 128
GLN A 270
None
0.96A 1xoqB-3t95A:
undetectable
1xoqB-3t95A:
25.64
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.
3tr9 DIHYDROPTEROATE
SYNTHASE


(Coxiella
burnetii)
PF00809
(Pterin_bind)
3 MET A 240
ASN A 206
GLN A 132
PT1  A1001 ( 4.2A)
None
PT1  A1001 ( 3.4A)
1.01A 1xoqB-3tr9A:
undetectable
1xoqB-3tr9A:
19.07
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.
3trj PHOSPHOHEPTOSE
ISOMERASE


(Francisella
tularensis)
PF13580
(SIS_2)
3 MET A 155
ASN A 126
GLN A  99
None
0.98A 1xoqB-3trjA:
undetectable
1xoqB-3trjA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uug MULTIPLE
SUGAR-BINDING
PERIPLASMIC RECEPTOR
CHVE


(Agrobacterium
fabrum)
PF13407
(Peripla_BP_4)
3 MET A 175
ASN A 108
GLN A 241
None
None
BDP  A 331 ( 4.1A)
1.04A 1xoqB-3uugA:
undetectable
1xoqB-3uugA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v8b PUTATIVE
DEHYDROGENASE,
POSSIBLY
3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE


(Sinorhizobium
meliloti)
PF13561
(adh_short_C2)
3 MET A  69
ASN A  89
GLN A 164
None
0.98A 1xoqB-3v8bA:
undetectable
1xoqB-3v8bA:
23.65
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.
3v8d CHOLESTEROL
7-ALPHA-MONOOXYGENAS
E


(Homo sapiens)
PF00067
(p450)
3 MET A 435
ASN A  81
GLN A  60
None
SO4  A 603 (-3.7A)
None
0.92A 1xoqB-3v8dA:
undetectable
1xoqB-3v8dA:
20.56
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.
3w0l GLUCOKINASE

(Xenopus laevis)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A  30
ASN A 224
GLN A 280
None
0.89A 1xoqB-3w0lA:
undetectable
1xoqB-3w0lA:
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.
3zei O-ACETYLSERINE
SULFHYDRYLASE


(Mycobacterium
tuberculosis)
PF00291
(PALP)
3 MET A  98
ASN A  74
GLN A 144
None
PLP  A1301 (-3.8A)
AWH  A1302 (-3.3A)
0.90A 1xoqB-3zeiA:
undetectable
1xoqB-3zeiA:
21.88
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.
4aec CYSTEINE SYNTHASE,
MITOCHONDRIAL


(Arabidopsis
thaliana)
PF00291
(PALP)
3 MET A 209
ASN A 185
GLN A 255
None
PLP  A 500 (-3.8A)
None
0.82A 1xoqB-4aecA:
undetectable
1xoqB-4aecA:
20.84
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.
4af0 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Cryptococcus
neoformans)
PF00478
(IMPDH)
PF00571
(CBS)
3 MET B 351
ASN B 317
GLN B 323
MOA  B1526 ( 4.7A)
MOA  B1526 ( 3.6A)
None
1.01A 1xoqB-4af0B:
undetectable
1xoqB-4af0B:
23.39
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata)
PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s)
3 MET A1486
ASN A1412
GLN A1469
None
0.92A 1xoqB-4bedA:
undetectable
1xoqB-4bedA:
12.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c1t SUGAR TRANSPORTER
SOLUTE-BINDING
PROTEIN


(Bifidobacterium
animalis)
PF01547
(SBP_bac_1)
3 MET A 274
ASN A  39
GLN A  71
None
XYP  A1003 (-3.3A)
None
1.03A 1xoqB-4c1tA:
undetectable
1xoqB-4c1tA:
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.
4cyf PANTETHEINASE

(Homo sapiens)
PF00795
(CN_hydrolase)
3 MET A 239
ASN A  86
GLN A 187
None
0.82A 1xoqB-4cyfA:
undetectable
1xoqB-4cyfA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dpk MALONYL-COA/SUCCINYL
-COA REDUCTASE


(Sulfurisphaera
tokodaii)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
3 MET A  26
ASN A 109
GLN A 156
None
1.06A 1xoqB-4dpkA:
undetectable
1xoqB-4dpkA:
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.
4dwe UNCHARACTERIZED
PROTEIN


(Bacteroides
ovatus)
PF15421
(Polysacc_deac_3)
3 MET A 420
ASN A 447
GLN A 155
None
1.03A 1xoqB-4dweA:
undetectable
1xoqB-4dweA:
21.57
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.
4e5v PUTATIVE THUA-LIKE
PROTEIN


(Parabacteroides
merdae)
PF06283
(ThuA)
3 MET A 260
ASN A  37
GLN A  42
None
1.03A 1xoqB-4e5vA:
undetectable
1xoqB-4e5vA:
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.
4f9o HEXOKINASE-1

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A 491
ASN A 683
GLN A 739
None
BGC  A1003 (-3.9A)
BGC  A1003 (-4.4A)
0.78A 1xoqB-4f9oA:
undetectable
1xoqB-4f9oA:
16.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i15 CLASS 1
PHOSPHODIESTERASE
PDEB1


(Trypanosoma
brucei)
PF00233
(PDEase_I)
3 MET A 785
ASN A 825
GLN A 874
None
0.69A 1xoqB-4i15A:
38.7
1xoqB-4i15A:
32.23
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.
4jzn ANTI-HCV E2 FAB
HC84-1 HEAVY CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
3 MET A  81
ASN A  85
GLN A  65
None
1.05A 1xoqB-4jznA:
undetectable
1xoqB-4jznA:
21.19
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.
4kds PLASMINOGEN
ACTIVATOR INHIBITOR
1


(Oncorhynchus
mykiss)
PF00079
(Serpin)
3 MET A 287
ASN A  28
GLN A 316
None
0.92A 1xoqB-4kdsA:
undetectable
1xoqB-4kdsA:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l5n URACIL-DNA
GLYCOSYLASE
EARLY PROTEIN GP1B


(Human
alphaherpesvirus
1;
Bacillus virus
phi29)
PF03167
(UDG)
no annotation
3 MET C  14
ASN C  42
GLN A  95
None
ACT  A 301 ( 4.9A)
None
1.04A 1xoqB-4l5nC:
undetectable
1xoqB-4l5nC:
10.15
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.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]


(Synechocystis
sp. PCC 6803)
PF02347
(GDC-P)
3 MET A 177
ASN A 210
GLN A 599
None
1.05A 1xoqB-4lglA:
undetectable
1xoqB-4lglA:
16.22
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.
4li3 CYSTEINE SYNTHASE

(Haemophilus
influenzae)
PF00291
(PALP)
3 MET X  96
ASN X  72
GLN X 143
None
LLP  X  42 ( 3.8A)
LLP  X  42 ( 4.9A)
0.92A 1xoqB-4li3X:
undetectable
1xoqB-4li3X:
20.92
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.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE


(Sulfolobus
solfataricus)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
3 MET A 359
ASN A  70
GLN A 381
None
0.99A 1xoqB-4mmoA:
undetectable
1xoqB-4mmoA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mnp N-ACETYLNEURAMINATE-
BINDING PROTEIN


(Fusobacterium
nucleatum)
PF03480
(DctP)
3 MET A  54
ASN A  44
GLN A  16
None
1.04A 1xoqB-4mnpA:
undetectable
1xoqB-4mnpA:
19.45
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.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 MET A  62
ASN A 256
GLN A 312
None
BGC  A 501 (-3.7A)
BGC  A 501 ( 4.4A)
0.77A 1xoqB-4qs9A:
undetectable
1xoqB-4qs9A:
22.51
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.
4r9o PUTATIVE ALDO/KETO
REDUCTASE


(Salmonella
enterica)
PF00248
(Aldo_ket_red)
3 MET A 134
ASN A 179
GLN A 198
None
0.86A 1xoqB-4r9oA:
undetectable
1xoqB-4r9oA:
23.73
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.
4to8 FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE,
CLASS II


(Staphylococcus
aureus)
PF01116
(F_bP_aldolase)
3 MET A  57
ASN A 233
GLN A  22
None
FLC  A 302 (-4.2A)
None
1.06A 1xoqB-4to8A:
undetectable
1xoqB-4to8A:
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.
4tv7 HTH-TYPE
TRANSCRIPTIONAL
REGULATORY PROTEIN
GABR


(Bacillus
subtilis)
PF00155
(Aminotran_1_2)
PF00392
(GntR)
3 MET A 200
ASN A 214
GLN A 186
None
1.03A 1xoqB-4tv7A:
undetectable
1xoqB-4tv7A:
21.60
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.
4w66 GLUTATHIONE
S-TRANSFERASE DOMAIN
PROTEIN


(Haliangium
ochraceum)
PF14497
(GST_C_3)
3 MET A 222
ASN A 118
GLN A 130
None
1.01A 1xoqB-4w66A:
undetectable
1xoqB-4w66A:
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.
4wvm STONUSTOXIN SUBUNIT
BETA


(Synanceia
horrida)
PF00622
(SPRY)
PF13765
(PRY)
3 MET B  69
ASN B  95
GLN B  96
None
1.05A 1xoqB-4wvmB:
undetectable
1xoqB-4wvmB:
17.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B


(Homo sapiens)
PF00233
(PDEase_I)
3 MET A 519
ASN A 567
GLN A 615
None
0.43A 1xoqB-4wziA:
52.6
1xoqB-4wziA:
48.52
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.
4xfe TRAP DICARBOXYLATE
TRANSPORTER SUBUNIT
DCTP


(Pseudomonas
putida)
PF03480
(DctP)
3 MET A 265
ASN A 326
GLN A 330
None
0.78A 1xoqB-4xfeA:
undetectable
1xoqB-4xfeA:
21.54
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.
4xhp PARM HYBRID FUSION
PROTEIN


(Bacillus
thuringiensis)
no annotation 3 MET A 134
ASN A 194
GLN A 415
None
1.06A 1xoqB-4xhpA:
undetectable
1xoqB-4xhpA:
16.86
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.
4zg8 ENDOGLUCANASE

(Perinereis
brevicirris)
PF00759
(Glyco_hydro_9)
3 MET A 237
ASN A 272
GLN A 246
None
0.99A 1xoqB-4zg8A:
undetectable
1xoqB-4zg8A:
23.41
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.
5dvj BINDING PROTEIN
COMPONENT OF ABC
SUGAR TRANSPORTER


(Pseudomonas
putida)
PF01547
(SBP_bac_1)
3 MET A 129
ASN A 141
GLN A 332
None
1.01A 1xoqB-5dvjA:
undetectable
1xoqB-5dvjA:
24.60
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C)
3 MET A 753
ASN A 436
GLN A1235
FES  A3001 (-4.9A)
None
None
1.03A 1xoqB-5epgA:
undetectable
1xoqB-5epgA:
13.29
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.
5fl7 ATP SYNTHASE SUBUNIT
ALPHA


(Yarrowia
lipolytica)
PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N)
3 MET A 409
ASN A 211
GLN A 456
None
1.02A 1xoqB-5fl7A:
undetectable
1xoqB-5fl7A:
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.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN


(Bacteroides
thetaiotaomicron)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
3 MET B 753
ASN B  98
GLN B  72
None
0.88A 1xoqB-5fq6B:
undetectable
1xoqB-5fq6B:
15.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5h2r PHOSPHODIESTERASE

(Trypanosoma
brucei)
no annotation 3 MET A 785
ASN A 826
GLN A 875
LLN  A1003 (-4.0A)
LLN  A1003 (-4.4A)
LLN  A1003 (-3.0A)
0.40A 1xoqB-5h2rA:
39.2
1xoqB-5h2rA:
32.68
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.
5h60 TRANSFERASE

(Escherichia
coli)
no annotation 3 MET A 276
ASN A 256
GLN A  50
None
None
UDP  A 401 (-4.6A)
1.04A 1xoqB-5h60A:
undetectable
1xoqB-5h60A:
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.
5jkj ESTERASE E22

(uncultured
bacterium)
PF00561
(Abhydrolase_1)
3 MET A 358
ASN A 320
GLN A 203
None
0.81A 1xoqB-5jkjA:
undetectable
1xoqB-5jkjA:
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.
5l8s AMINO ACYL PEPTIDASE

(Sporosarcina
psychrophila)
PF00326
(Peptidase_S9)
3 MET A 341
ASN A 331
GLN A 327
None
0.93A 1xoqB-5l8sA:
undetectable
1xoqB-5l8sA:
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.
5ls6 HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2,HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2,HISTONE-LYSINE
N-METHYLTRANSFERASE
EZH2
POLYCOMB PROTEIN
SUZ12


(Homo sapiens;
Homo sapiens)
PF00856
(SET)
PF11616
(EZH2_WD-Binding)
PF09733
(VEFS-Box)
3 MET A 439
ASN C 651
GLN C 685
None
0.98A 1xoqB-5ls6A:
undetectable
1xoqB-5ls6A:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lun 2-OXOGLUTARATE-DEPEN
DENT
ETHYLENE/SUCCINATE-F
ORMING ENZYME


(Pseudomonas
savastanoi)
PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N)
3 MET A 313
ASN A 218
GLN A 256
ARG  A 403 ( 4.6A)
None
None
0.97A 1xoqB-5lunA:
undetectable
1xoqB-5lunA:
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.
5m28 MALE1

(Lactobacillus
casei)
PF13416
(SBP_bac_8)
3 MET A 120
ASN A 105
GLN A 300
None
0.89A 1xoqB-5m28A:
undetectable
1xoqB-5m28A:
18.68
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.
5ncs SERPIN

(Tannerella
forsythia)
PF00079
(Serpin)
3 MET A 231
ASN A 378
GLN A 247
None
0.88A 1xoqB-5ncsA:
undetectable
1xoqB-5ncsA:
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.
5ohj CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B


(Homo sapiens)
no annotation 3 MET A 519
ASN A 567
GLN A 615
9VE  A 801 (-3.8A)
9VE  A 801 (-4.1A)
9VE  A 801 (-3.2A)
0.31A 1xoqB-5ohjA:
51.9
1xoqB-5ohjA:
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.
5wh6 CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D


(Homo sapiens)
no annotation 3 MET A 273
ASN A 321
GLN A 369
AKJ  A 601 ( 3.9A)
AKJ  A 601 (-4.3A)
AKJ  A 601 (-3.0A)
0.11A 1xoqB-5wh6A:
55.1
1xoqB-5wh6A:
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.
5xa2 CYSTEINE SYNTHASE

(Planctopirus
limnophila)
PF00291
(PALP)
3 MET A  98
ASN A  74
GLN A 143
None
LLP  A  44 ( 3.8A)
LLP  A  44 ( 4.8A)
0.71A 1xoqB-5xa2A:
undetectable
1xoqB-5xa2A:
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.
5y7f UGGT

(Thermomyces
dupontii)
PF01501
(Glyco_transf_8)
3 MET A1321
ASN A1431
GLN A1445
None
0.98A 1xoqB-5y7fA:
undetectable
1xoqB-5y7fA:
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.
5ygu DIAMINOPIMELATE
EPIMERASE


(Escherichia
coli)
no annotation 3 MET A 118
ASN A  11
GLN A  44
None
IOD  A 308 (-4.5A)
None
0.71A 1xoqB-5yguA:
undetectable
1xoqB-5yguA:
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.
5yy0 CYTOSOLIC
NIFE-HYDROGENASE,
ALPHA SUBUNIT


(Thermococcus
kodakarensis)
no annotation 3 MET A 269
ASN A 307
GLN A 204
None
1.01A 1xoqB-5yy0A:
undetectable
1xoqB-5yy0A:
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.
6au1 PUTATIVE HEMIN
STORAGE PROTEIN


(Bordetella
bronchiseptica)
no annotation 3 MET A 584
ASN A 547
GLN A 564
None
0.86A 1xoqB-6au1A:
undetectable
1xoqB-6au1A:
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.
6epd PROTEASOME SUBUNIT
BETA TYPE-4


(Rattus
norvegicus)
no annotation 3 MET 7  70
ASN 7  90
GLN 7 113
None
1.03A 1xoqB-6epd7:
undetectable
1xoqB-6epd7:
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.
6fsa -

(-)
no annotation 3 MET A 439
ASN A 232
GLN A 288
None
MG  A2001 ( 4.5A)
None
1.05A 1xoqB-6fsaA:
undetectable
1xoqB-6fsaA:
undetectable