Target Pathogen

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Pockets High Medium Low

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #4

0.484

Site 2 FPocket #10

0.399

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.513

Site 2 P2Rank #2

0.489

Site 3 P2Rank #3

0.447

Site 4 P2Rank #4

0.394

Site 5 P2Rank #5

0.382

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #3

0.597

Site 2 FPocket #2

0.555

Site 3 FPocket #6

0.321

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.904

Site 2 P2Rank #2

0.775

Site 3 P2Rank #3

0.408

Site 4 P2Rank #4

0.388

Site 5 P2Rank #5

0.344

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #27

0.493

Site 2 FPocket #5

0.353

Site 3 FPocket #2

0.217

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.714

Site 2 P2Rank #2

0.344

Site 3 P2Rank #3

0.272

Site 4 P2Rank #4

0.23

Site 5 P2Rank #5

0.084

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.902

Site 2 FPocket #5

0.358

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.513

Site 2 P2Rank #2

0.003

Site 3 P2Rank #3

0.0

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.442

Site 2 FPocket #24

0.277

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.573

Site 2 P2Rank #2

0.373

Site 3 P2Rank #3

0.321

Site 4 P2Rank #4

0.209

Site 5 P2Rank #5

0.098

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #5

0.626

Site 2 FPocket #2

0.292

Site 3 FPocket #8

0.258

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.523

Site 2 P2Rank #2

0.415

Site 3 P2Rank #3

0.141

Site 4 P2Rank #4

0.055

Site 5 P2Rank #5

0.042

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.765

Site 2 FPocket #9

0.67

Site 3 FPocket #3

0.517

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.497

Site 2 P2Rank #2

0.454

Site 3 P2Rank #3

0.118

Site 4 P2Rank #4

0.095

Site 5 P2Rank #5

0.082

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #4

0.743

Site 2 FPocket #3

0.66

Site 3 FPocket #10

0.337

Site 4 FPocket #1

0.278

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.61

Site 2 P2Rank #2

0.499

Site 3 P2Rank #3

0.17

Site 4 P2Rank #4

0.115

Site 5 P2Rank #5

0.075

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #2

0.886

Site 2 FPocket #3

0.573

Site 3 FPocket #1

0.465

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.622

Site 2 P2Rank #2

0.523

Site 3 P2Rank #3

0.158

Site 4 P2Rank #4

0.074

Site 5 P2Rank #5

0.074

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.322

Site 2 FPocket #19

0.307

Site 3 FPocket #18

0.301

Site 4 FPocket #4

0.283

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.602

Site 2 P2Rank #2

0.508

Site 3 P2Rank #3

0.156

Site 4 P2Rank #4

0.112

Site 5 P2Rank #5

0.082

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.926

Site 2 FPocket #3

0.462

Site 3 FPocket #9

0.421

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.571

Site 2 P2Rank #2

0.543

Site 3 P2Rank #3

0.092

Site 4 P2Rank #4

0.067

Site 5 P2Rank #5

0.046

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #2

0.686

Site 2 FPocket #6

0.37

Site 3 FPocket #1

0.327

Site 4 FPocket #13

0.218

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.556

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #2

0.464

Site 2 FPocket #5

0.34

Site 3 FPocket #1

0.248

Site 4 FPocket #7

0.204

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.357

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #5

0.997

Site 2 FPocket #1

0.87

Site 3 FPocket #22

0.391

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.489

Site 2 P2Rank #2

0.381

Site 3 P2Rank #3

0.38

Site 4 P2Rank #4

0.347

Site 5 P2Rank #5

0.292

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #29

0.995

Site 2 FPocket #1

0.85

Site 3 FPocket #4

0.358

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.539

Site 2 P2Rank #2

0.417

Site 3 P2Rank #3

0.361

Site 4 P2Rank #4

0.304

Site 5 P2Rank #5

0.256

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #2

0.996

Site 2 FPocket #1

0.736

Site 3 FPocket #5

0.73

Site 4 FPocket #57

0.263

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.558

Site 2 P2Rank #2

0.509

Site 3 P2Rank #3

0.353

Site 4 P2Rank #4

0.352

Site 5 P2Rank #5

0.343

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.942

Site 2 FPocket #52

0.855

Site 3 FPocket #4

0.264

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.618

Site 2 P2Rank #2

0.569

Site 3 P2Rank #3

0.464

Site 4 P2Rank #4

0.458

Site 5 P2Rank #5

0.293

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.828

Site 2 FPocket #11

0.37

Site 3 FPocket #2

0.316

Site 4 FPocket #9

0.204

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.512

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.55

Site 2 FPocket #15

0.546

Site 3 FPocket #3

0.498

Site 4 FPocket #11

0.394

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.71

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #2

0.87

Site 2 FPocket #13

0.561

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.471

Site 2 P2Rank #2

0.377

Site 3 P2Rank #3

0.308

Site 4 P2Rank #4

0.301

Site 5 P2Rank #5

0.248

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #9

0.57

Site 2 FPocket #20

0.231

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.615

Site 2 P2Rank #2

0.43

Site 3 P2Rank #3

0.049

Site 4 P2Rank #4

0.019

Site 5 P2Rank #5

0.001

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #7

0.439

Site 2 FPocket #8

0.434

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.621

Site 2 P2Rank #2

0.614

Site 3 P2Rank #3

0.315

Site 4 P2Rank #4

0.059

Site 5 P2Rank #5

0.015

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.772

Site 2 FPocket #5

0.563

Site 3 FPocket #31

0.236

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.66

Site 2 P2Rank #2

0.627

Site 3 P2Rank #3

0.16

Site 4 P2Rank #4

0.002

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.979

Site 2 FPocket #2

0.965

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.253

Site 2 P2Rank #2

0.25

Site 3 P2Rank #3

0.022

Site 4 P2Rank #4

0.006

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #5

0.557

Site 2 FPocket #1

0.339

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.722

Site 2 P2Rank #2

0.596

Site 3 P2Rank #3

0.025

Site 4 P2Rank #4

0.016

Site 5 P2Rank #5

0.008

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #1

0.819

Site 2 FPocket #4

0.375

Site 3 FPocket #9

0.34

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.672

Site 2 P2Rank #2

0.662

Site 3 P2Rank #3

0.105

Site 4 P2Rank #4

0.037

Site 5 P2Rank #5

0.006

Binding pockets · FPocket

Druggability: high ≥ 0.7 · medium 0.4–0.69 · low < 0.4

Site 1 FPocket #4

0.926

Site 2 FPocket #1

0.737

Site 3 FPocket #58

0.469

Binding pockets · P2Rank

Probability: high ≥ 0.5 · medium 0.2–0.49 · low < 0.2

Site 1 P2Rank #1

0.385

Site 2 P2Rank #2

0.374

Site 3 P2Rank #3

0.298

Site 4 P2Rank #4

0.21

Site 5 P2Rank #5

0.2