9D51

Structure of PAK2 in complex with compound 12

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (B, A)	PAK-2p34	polymer	297	33259.5	2	UniProt (Q13177) Pfam (PF00069)	Homo sapiens (human)	p34,C-t-PAK2
2	C, D (B, A)	N~2~-{[(1s,4s)-4-aminocyclohexyl]methyl}-N~4~-[5-(trifluoromethyl)-1,3-thiazol-2-yl]pyrimidine-2,4-diamine	non-polymer		372.4	2	Chemie (A1A2Q)
3	E, F (B, A)	water	water		18.0	16	Chemie (HOH)

Sequence modifications

B, A: 228 - 524 (UniProt: Q13177)

PDB	External Database	Details
Asn 368	Asp 368	engineered mutation
Glu 402	Thr 402	engineered mutation
Gln 498	Pro 498	engineered mutation
Ala 514	Met 514	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	66519.0
Non-Polymers*	Number of molecules	2
	Total formula weight	744.8
All*	Total formula weight	67263.9

*Water molecules are not included.