Table 2.

Top 20 pockets across the P. falciparum proteome ranked by drugability score.

Protein	Pocket #	Ligands	Seq. Ident.	Rel. Ident.	Hs Ident.	Vol. (Å3)	Area (Å2)	Res. (Å)	Score
PNP	1	inhibitor (IMH)	1.00	1.25	0.56	590	513	2.20	−2.95
PNP	2		1.00	1.25	0.50	274	290	2.20	−2.56
LDH	1		1.00	1.07	0.56	466	406	1.70	−2.49
ENR*	1	inhibitor (TCC)	1.00	1.17	0.57	410	362	2.35	−2.47
TIM	1		0.94	1.17	0.81	448	407	1.10	−2.45
DHFR-TS*	3	inhibitor (WRA)	1.00	1.25	0.79	432	375	2.33	−2.35
HGXPRT	3		1.00	1.25	0.75	269	323	2.00	−2.29
PNP	3		1.00	1.25	0.50	174	323	2.20	−2.18
PM2	1	inhibitor (R37)	0.88	1.28	0.80	518	485	1.80	−2.15
AdSS	3	product (GDP)	0.95	1.23	0.82	396	442	2.00	−2.06
LDH	2	inhibitor (OXQ), cofactor	1.00	1.07	0.76	420	390	1.70	−1.88
KinI	2		1.00	1.10	0.65	263	297	1.60	−1.83
AdSS	2		0.94	1.22	0.83	469	348	2.00	−1.65
GR	4		1.00	1.16	0.71	269	416	2.60	−1.57
ENR*	2		0.94	1.10	0.63	381	412	2.35	−1.57
ENR*	3		1.00	1.17	0.64	232	298	2.35	−1.56
KinI	1		1.00	1.10	0.85	442	464	1.60	−1.54
ACBP	1	payload (COA), payload (MYR)	0.85	1.22	0.77	318	367	2.00	−1.41
DHFR-TS*	7		1.00	1.25	0.69	210	210	2.33	−1.36
ENR	2		0.94	1.10	0.63	295	355	2.35	−1.23

^*Starred protein names indicate pockets in which a cofactor was included in the template structure. The columns indicate abbreviated protein name, pocket number of the original protein, presence of cofactor or ligand, sequence identity between P. falciparum and P. yoelii, relative sequence identity between pocket residues and other surface residues, sequence identity to H. sapiens, volume and area of each pocket, and resolution of original protein. See supplementary material for full table.