SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2bib'

List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
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.
1FM9_A_9CRA201_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.85A 1fm9A-2bibA:
undetectable
1fm9A-2bibA:
17.00
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.
1HBP_A_RTLA184_0
(RETINOL BINDING
PROTEIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 11 LEU A 248
PHE A  80
ALA A  30
VAL A 250
MET A 159
None
1.11A 1hbpA-2bibA:
undetectable
1hbpA-2bibA:
14.98
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.
1JHQ_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 THR A 520
PHE A 507
LEU A 515
GLY A 530
None
0.76A 1jhqA-2bibA:
undetectable
1jhqA-2bibA:
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.
1JHV_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 THR A 520
PHE A 507
LEU A 515
GLY A 530
None
0.70A 1jhvA-2bibA:
undetectable
1jhvA-2bibA:
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.
1K74_A_9CRA463_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.88A 1k74A-2bibA:
undetectable
1k74A-2bibA:
17.00
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.
1LHV_A_NOGA301_1
(SEX HORMONE-BINDING
GLOBULIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 THR A  86
ASP A 182
ASN A 185
LEU A 133
None
1.04A 1lhvA-2bibA:
undetectable
1lhvA-2bibA:
15.54
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.
1P6K_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 SER A  25
GLN A 155
PHE A 156
ASN A   6
None
1.12A 1p6kA-2bibA:
undetectable
1p6kA-2bibA:
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.
1RBP_A_RTLA183_0
(PLASMA
RETINOL-BINDING
PROTEIN PRECURSOR)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 LEU A 248
PHE A  80
ALA A  30
VAL A 250
MET A 159
None
1.09A 1rbpA-2bibA:
undetectable
1rbpA-2bibA:
14.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS6_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 SER A  25
GLN A 155
PHE A 156
ASN A   6
None
1.08A 1rs6A-2bibA:
undetectable
1rs6A-2bibA:
20.35
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.
1RS6_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 SER A  25
GLN A 155
PHE A 156
ASN A   6
None
1.05A 1rs6B-2bibA:
undetectable
1rs6B-2bibA:
20.35
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.
1XIU_B_9CRB202_1
(RXR-LIKE PROTEIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.97A 1xiuB-2bibA:
undetectable
1xiuB-2bibA:
16.73
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.
1XLS_B_9CRB802_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.89A 1xlsB-2bibA:
undetectable
1xlsB-2bibA:
16.64
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.
1XLS_C_9CRC803_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.90A 1xlsC-2bibA:
undetectable
1xlsC-2bibA:
16.64
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.
1XLS_D_9CRD804_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.89A 1xlsD-2bibA:
undetectable
1xlsD-2bibA:
16.64
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.
1ZZQ_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 SER A  25
GLN A 155
PHE A 156
ASN A   6
None
1.11A 1zzqA-2bibA:
undetectable
1zzqA-2bibA:
22.11
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.
1ZZU_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 SER A  25
GLN A 155
PHE A 156
ASN A   6
None
1.10A 1zzuA-2bibA:
undetectable
1zzuA-2bibA:
22.11
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.
2IZQ_A_DVAA6_0
(GRAMICIDIN D)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
3 / 3 ALA A 210
VAL A 207
TRP A 180
None
0.95A 2izqA-2bibA:
undetectable
2izqB-2bibA:
undetectable
2izqA-2bibA:
2.24
2izqB-2bibA:
2.24
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.
2Q6K_A_ADNA699_1
(CHLORINASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 7 ASP A  42
PHE A  40
TYR A  48
PRO A  41
None
1.48A 2q6kA-2bibA:
undetectable
2q6kA-2bibA:
18.82
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.
2TOD_A_DMOA700_1
(PROTEIN (ORNITHINE
DECARBOXYLASE))
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 231
PHE A 226
ASP A 263
TYR A 266
None
1.14A 2todA-2bibA:
0.4
2todB-2bibA:
0.3
2todA-2bibA:
21.13
2todB-2bibA:
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.
2TOD_C_DMOC700_1
(PROTEIN (ORNITHINE
DECARBOXYLASE))
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 5 ASP A 231
PHE A 226
ASP A 263
TYR A 266
None
1.15A 2todC-2bibA:
0.0
2todD-2bibA:
0.3
2todC-2bibA:
21.13
2todD-2bibA:
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.
2TOD_D_DMOD700_1
(PROTEIN (ORNITHINE
DECARBOXYLASE))
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 5 ASP A 263
TYR A 266
ASP A 231
PHE A 226
None
1.15A 2todC-2bibA:
0.0
2todD-2bibA:
0.3
2todC-2bibA:
21.13
2todD-2bibA:
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.
2X8O_A_OINA1317_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 358
TRP A 365
TYR A 386
MET A 394
None
0.39A 2x8oA-2bibA:
7.7
2x8oA-2bibA:
25.09
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.
2X8O_A_OINA1317_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 378
TRP A 385
TYR A 406
MET A 414
BTB  A1546 (-3.8A)
BTB  A1546 (-4.0A)
BTB  A1546 (-4.6A)
BTB  A1546 (-3.6A)
0.31A 2x8oA-2bibA:
7.7
2x8oA-2bibA:
25.09
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.
2X8O_A_OINA1317_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 398
TRP A 405
TYR A 426
MET A 434
BTB  A1545 (-3.6A)
BTB  A1545 (-3.8A)
BTB  A1545 (-4.9A)
BTB  A1545 ( 3.9A)
0.39A 2x8oA-2bibA:
7.7
2x8oA-2bibA:
25.09
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.
2X8O_A_OINA1317_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 418
TRP A 425
TYR A 446
MET A 454
BTB  A1542 ( 3.8A)
BTB  A1542 (-3.5A)
BTB  A1542 (-4.5A)
BTB  A1542 (-3.1A)
0.29A 2x8oA-2bibA:
7.7
2x8oA-2bibA:
25.09
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.
2X8O_A_OINA1317_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 438
TRP A 445
TYR A 466
MET A 474
BTB  A1547 (-3.5A)
BTB  A1547 (-3.6A)
BTB  A1547 (-4.4A)
BTB  A1547 ( 4.3A)
0.23A 2x8oA-2bibA:
7.7
2x8oA-2bibA:
25.09
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.
2X8P_A_OINA1313_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 314
LYS A 316
TRP A 322
TYR A 345
None
0.66A 2x8pA-2bibA:
15.0
2x8pA-2bibA:
25.09
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.
2X8P_A_OINA1313_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 358
LYS A 360
TRP A 365
TYR A 386
None
0.34A 2x8pA-2bibA:
15.0
2x8pA-2bibA:
25.09
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.
2X8P_A_OINA1313_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 378
LYS A 380
TRP A 385
TYR A 406
BTB  A1546 (-3.8A)
None
BTB  A1546 (-4.0A)
BTB  A1546 (-4.6A)
0.41A 2x8pA-2bibA:
15.0
2x8pA-2bibA:
25.09
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.
2X8P_A_OINA1313_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 438
LYS A 440
TRP A 445
TYR A 466
BTB  A1547 (-3.5A)
None
BTB  A1547 (-3.6A)
BTB  A1547 (-4.4A)
0.66A 2x8pA-2bibA:
15.0
2x8pA-2bibA:
25.09
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.
2X8P_A_OINA1313_1
(CHOLINE-BINDING
PROTEIN F)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TRP A 478
LYS A 480
TRP A 485
TYR A 506
BTB  A1548 (-3.6A)
None
BTB  A1548 ( 3.9A)
BTB  A1548 (-4.0A)
0.23A 2x8pA-2bibA:
15.0
2x8pA-2bibA:
25.09
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.
2Y00_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 LEU A  62
VAL A  61
THR A 252
SER A 235
ASN A 183
None
None
None
None
ZN  A1550 ( 2.6A)
1.43A 2y00B-2bibA:
undetectable
2y00B-2bibA:
15.90
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.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 LEU A  62
VAL A  61
THR A 252
SER A 235
ASN A 183
None
None
None
None
ZN  A1550 ( 2.6A)
1.45A 2y01B-2bibA:
undetectable
2y01B-2bibA:
15.90
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.
3D2T_A_1FLA502_1
(TRANSTHYRETIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 7 ALA A 280
SER A  18
THR A 252
VAL A 250
None
0.97A 3d2tA-2bibA:
undetectable
3d2tA-2bibA:
10.62
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.
3D2T_B_1FLB500_1
(TRANSTHYRETIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ALA A 280
SER A  18
THR A 252
VAL A 250
None
0.90A 3d2tB-2bibA:
undetectable
3d2tB-2bibA:
10.62
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.
3HAV_A_SRYA403_1
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 ASP A  37
ASP A  39
ASP A  33
ASP A 182
CA  A1552 ( 3.2A)
None
None
None
1.05A 3havA-2bibA:
undetectable
3havA-2bibA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JQ7_C_DX2C270_1
(PTERIDINE REDUCTASE
1)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 PHE A  10
ASP A  19
VAL A  32
LEU A  23
None
1.14A 3jq7C-2bibA:
2.4
3jq7C-2bibA:
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.
3KK6_A_CELA701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 HIS A   9
VAL A 250
SER A 301
LEU A 248
None
0.94A 3kk6A-2bibA:
undetectable
3kk6A-2bibA:
20.44
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.
3R24_A_SAMA302_1
(2'-O-METHYL
TRANSFERASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
3 / 3 TYR A 346
ASP A  39
ASP A  42
None
0.80A 3r24A-2bibA:
undetectable
3r24A-2bibA:
21.61
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.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 HIS A  85
GLY A 202
GLY A  16
ASN A 279
ZN  A1550 (-3.3A)
None
None
None
0.95A 3v3nB-2bibA:
undetectable
3v3nB-2bibA:
21.03
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.
3V3N_C_MIYC2001_1
(TETX2 PROTEIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 8 HIS A  85
GLY A 202
GLY A  16
ASN A 279
ZN  A1550 (-3.3A)
None
None
None
0.95A 3v3nC-2bibA:
undetectable
3v3nC-2bibA:
21.03
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.
4C1D_B_X8ZB350_1
(BETA-LACTAMASE CLASS
B VIM-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 HIS A  87
ASP A  89
HIS A  85
ASN A 183
HIS A 229
ZN  A1550 ( 3.1A)
ZN  A1549 ( 2.5A)
ZN  A1550 (-3.3A)
ZN  A1550 ( 2.6A)
ZN  A1549 ( 3.2A)
1.46A 4c1dB-2bibA:
10.1
4c1dB-2bibA:
18.82
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.
4C5N_B_PXLB300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 GLY A  92
ASP A  89
GLY A  35
HIS A  85
HIS A 229
CA  A1552 (-4.4A)
ZN  A1549 ( 2.5A)
None
ZN  A1550 (-3.3A)
ZN  A1549 ( 3.2A)
1.08A 4c5nB-2bibA:
undetectable
4c5nB-2bibA:
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.
4C5N_B_PXLB300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 GLY A  92
ASP A  89
GLY A  35
HIS A  87
VAL A  83
CA  A1552 (-4.4A)
ZN  A1549 ( 2.5A)
None
ZN  A1550 ( 3.1A)
None
1.31A 4c5nB-2bibA:
undetectable
4c5nB-2bibA:
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.
4C5N_D_UEGD300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 GLY A  92
ASP A  89
GLY A  35
VAL A  83
HIS A 229
CA  A1552 (-4.4A)
ZN  A1549 ( 2.5A)
None
None
ZN  A1549 ( 3.2A)
1.26A 4c5nD-2bibA:
undetectable
4c5nD-2bibA:
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.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ASN A 243
GLY A 209
ALA A 210
GLY A 215
LEU A 217
None
1.03A 4e1gA-2bibA:
undetectable
4e1gA-2bibA:
22.96
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.
4W5Q_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 182
LYS A 109
THR A  86
TYR A 111
None
1.44A 4w5qA-2bibA:
undetectable
4w5qA-2bibA:
19.81
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.
4W5R_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 182
LYS A 109
THR A  86
TYR A 111
None
1.43A 4w5rA-2bibA:
undetectable
4w5rA-2bibA:
19.81
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.
4W5T_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 182
LYS A 109
THR A  86
TYR A 111
None
1.43A 4w5tA-2bibA:
undetectable
4w5tA-2bibA:
19.81
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.
4Z4C_A_IPHA906_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 182
LYS A 109
THR A  86
TYR A 111
None
1.45A 4z4cA-2bibA:
undetectable
4z4cA-2bibA:
19.81
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.
4Z4F_A_IPHA904_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 6 ASP A 182
LYS A 109
THR A  86
TYR A 111
None
1.45A 4z4fA-2bibA:
undetectable
4z4fA-2bibA:
19.81
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.
4Z4I_A_IPHA902_0
(PROTEIN ARGONAUTE-2)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
4 / 4 TYR A 486
LYS A 481
GLU A 458
TYR A 467
None
1.43A 4z4iA-2bibA:
0.4
4z4iA-2bibA:
19.81
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.
5AYA_A_X8ZA307_1
(METALLO-BETA-LACTAMA
SE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 11 HIS A  85
HIS A  87
ASP A  89
HIS A  90
HIS A 229
ZN  A1550 (-3.3A)
ZN  A1550 ( 3.1A)
ZN  A1549 ( 2.5A)
ZN  A1549 (-3.2A)
ZN  A1549 ( 3.2A)
0.54A 5ayaA-2bibA:
11.0
5ayaA-2bibA:
17.83
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.
5NZW_A_9F2A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 HIS A  85
HIS A  87
HIS A  90
ASP A 203
HIS A 228
ZN  A1550 (-3.3A)
ZN  A1550 ( 3.1A)
ZN  A1549 (-3.2A)
ZN  A1549 (-2.3A)
PC  A1541 (-3.9A)
0.71A 5nzwA-2bibA:
7.4
5nzwA-2bibA:
21.96
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.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
3 / 3 HIS A 229
ASP A 203
HIS A  90
ZN  A1549 ( 3.2A)
ZN  A1549 (-2.3A)
ZN  A1549 (-3.2A)
0.80A 5oexA-2bibA:
undetectable
5oexA-2bibA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_A_PCFA1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 TYR A  58
ILE A  11
ILE A  22
LEU A  73
ILE A 307
None
1.37A 5vkqA-2bibA:
undetectable
5vkqD-2bibA:
undetectable
5vkqA-2bibA:
14.17
5vkqD-2bibA:
14.17
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.
5VKQ_B_PCFB1808_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 ILE A 307
TYR A  58
ILE A  11
ILE A  22
LEU A  73
None
1.36A 5vkqA-2bibA:
undetectable
5vkqB-2bibA:
undetectable
5vkqA-2bibA:
14.17
5vkqB-2bibA:
14.17
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.
5VKQ_D_PCFD1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 10 ILE A 307
TYR A  58
ILE A  11
ILE A  22
LEU A  73
None
1.34A 5vkqC-2bibA:
undetectable
5vkqD-2bibA:
undetectable
5vkqC-2bibA:
14.17
5vkqD-2bibA:
14.17
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.
5Z12_B_9CRB501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
5 / 12 ILE A  22
ALA A  20
LEU A  62
VAL A  75
LEU A  97
None
0.95A 5z12B-2bibA:
undetectable
5z12B-2bibA:
8.45
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.
6GBF_A_ACTA507_0
(MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN
CNX1)
2bib TEICHOIC ACID
PHOSPHORYLCHOLINE
ESTERASE/ CHOLINE
BINDING PROTEIN

(Streptococcus
pneumoniae)
3 / 3 LYS A 178
SER A 112
SER A 114
None
1.14A 6gbfA-2bibA:
undetectable
6gbfA-2bibA:
21.27