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 #3

0.384

Likely same site as P2Rank 2 3.3 Å 9 shared residues 100% of smaller site

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.876

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Surrounding area

Site 2 P2Rank #2

0.389

Likely same site as FPocket 3 3.3 Å 9 shared residues 100% of smaller site

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Surrounding area

Site 3 P2Rank #3

0.292

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Surrounding area

Site 4 P2Rank #4

0.16

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.757

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Surrounding area

Site 2 P2Rank #2

0.17

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Surrounding area

Site 3 P2Rank #3

0.146

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Surrounding area

Site 4 P2Rank #4

0.027

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Surrounding area

Site 5 P2Rank #5

0.024

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.661

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Surrounding area

Site 2 P2Rank #2

0.17

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Site 3 P2Rank #3

0.145

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Surrounding area

Site 4 P2Rank #4

0.017

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Site 5 P2Rank #5

0.015

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.725

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Surrounding area

Site 2 P2Rank #2

0.161

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Site 3 P2Rank #3

0.14

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Surrounding area

Site 4 P2Rank #4

0.05

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Site 5 P2Rank #5

0.006

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.765

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Surrounding area

Site 2 P2Rank #2

0.245

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Surrounding area

Site 3 P2Rank #3

0.168

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Surrounding area

Site 4 P2Rank #4

0.137

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.758

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Surrounding area

Site 2 P2Rank #2

0.201

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Surrounding area

Site 3 P2Rank #3

0.163

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Surrounding area

Site 4 P2Rank #4

0.024

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Site 5 P2Rank #5

0.021

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Surrounding area

Binding pockets · FPocket

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

Site 1 FPocket #3

0.953

Likely same site as P2Rank 4 1.6 Å 11 shared residues 92% of smaller site

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Surrounding area

Site 2 FPocket #1

0.366

Likely same site as P2Rank 1 7.9 Å 15 shared residues 62% of smaller site

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Surrounding area

Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.794

Likely same site as FPocket 1 7.9 Å 15 shared residues 62% of smaller site

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Surrounding area

Site 2 P2Rank #2

0.185

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Surrounding area

Site 3 P2Rank #3

0.151

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Surrounding area

Site 4 P2Rank #4

0.048

Likely same site as FPocket 3 1.6 Å 11 shared residues 92% of smaller site

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Surrounding area

Site 5 P2Rank #5

0.034

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Surrounding area

Binding pockets · FPocket

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

Site 1 FPocket #3

0.953

Likely same site as P2Rank 4 1.6 Å 11 shared residues 92% of smaller site

Unusual size

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Surrounding area

Site 2 FPocket #1

0.311

Likely same site as P2Rank 1 7.9 Å 15 shared residues 62% of smaller site

Unusual size

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Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.794

Likely same site as FPocket 1 7.9 Å 15 shared residues 62% of smaller site

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Surrounding area

Site 2 P2Rank #2

0.185

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Site 3 P2Rank #3

0.151

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Surrounding area

Site 4 P2Rank #4

0.048

Likely same site as FPocket 3 1.6 Å 11 shared residues 92% of smaller site

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Surrounding area

Site 5 P2Rank #5

0.034

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Surrounding area