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 #1

0.776

Likely same site as P2Rank 1 4.8 Å 33 shared residues 80% of smaller site

Unusual size

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Surrounding area

Site 2 FPocket #47

0.347

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Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.972

Likely same site as FPocket 1 4.8 Å 33 shared residues 80% of smaller site

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Surrounding area

Site 2 P2Rank #2

0.295

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Site 3 P2Rank #3

0.277

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Site 4 P2Rank #4

0.237

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Site 5 P2Rank #5

0.154

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Binding pockets · FPocket

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

Site 1 FPocket #91

0.984

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Site 2 FPocket #16

0.59

Likely same site as P2Rank 2 2.3 Å 28 shared residues 97% of smaller site

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Site 3 FPocket #90

0.549

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Site 4 FPocket #87

0.479

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Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.969

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Site 2 P2Rank #2

0.955

Likely same site as FPocket 16 2.3 Å 28 shared residues 97% of smaller site

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Site 3 P2Rank #3

0.95

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Site 4 P2Rank #4

0.891

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Site 5 P2Rank #5

0.418

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Binding pockets · FPocket

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

Site 1 FPocket #47

0.984

Unusual size

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Site 2 FPocket #1

0.577

Likely same site as P2Rank 1 1.4 Å 28 shared residues 90% of smaller site

Unusual size

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Site 3 FPocket #49

0.549

Likely same site as P2Rank 4 3.5 Å 15 shared residues 100% of smaller site

Unusual size

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Site 4 FPocket #6

0.362

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Binding pockets · P2Rank

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

Site 1 P2Rank #1

0.969

Likely same site as FPocket 1 1.4 Å 28 shared residues 90% of smaller site

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Surrounding area

Site 2 P2Rank #2

0.418

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Site 3 P2Rank #3

0.354

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Site 4 P2Rank #4

0.332

Likely same site as FPocket 49 3.5 Å 15 shared residues 100% of smaller site

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Site 5 P2Rank #5

0.158

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