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 #2

0.833

Likely same site as P2Rank 3 2.1 Å 7 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

0.367

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Surrounding area

Site 2 P2Rank #2

0.093

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Site 3 P2Rank #3

0.067

Likely same site as FPocket 2 2.1 Å 7 shared residues 100% of smaller site

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Site 4 P2Rank #4

0.041

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Residue sets

UniProt: Active site:118-118 Proton donor/acceptor

UniProt: Active site:225-225 Proton donor/acceptor

UniProt: Binding site:167-167

UniProt: Binding site:26-27

UniProt: Binding site:43-44

UniProt: Binding site:72-73

UniProt: Binding site:74-74

UniProt: Binding site:93-93

UniProt: Binding site:95-95

Binding pockets · FPocket

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

Site 1 FPocket #1

0.653

Likely same site as P2Rank 4 1.8 Å 7 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

0.432

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Surrounding area

Site 2 P2Rank #2

0.255

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Site 3 P2Rank #3

0.049

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Site 4 P2Rank #4

0.026

Likely same site as FPocket 1 1.8 Å 7 shared residues 100% of smaller site

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Surrounding area