6VPL

TPX2 residues 7-20 fused to Aurora A residues 116-389 with C290 disulfide bonded to compound 7-80, and in complex with AMP-PNP

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	TPX2 fragment - Aurora A kinase domain fusion	polymer	292	33986.7	2	UniProt (Q9ULW0) UniProt (O14965) Pfam (PF00069)	Homo sapiens (Human)	Targeting protein for Xklp2,Aurora kinase A,Differentially expressed in cancerous and non-cancerous lung cells 2,DIL-2,Hepatocellular carcinoma-associated antigen 519,Hepatocellular carcinoma-associated antigen 90,Protein fls353,Restricted expression proliferation-associated protein 100,p100,Aurora 2,Aurora/IPL1-related kinase 1,hARK1,Breast tumor-amplified kinase,Serine/threonine-protein kinase 15,Serine/threonine-protein kinase 6,Serine/threonine-protein kinase aurora-A
2	C, F, G, L (A, B)	MAGNESIUM ION	non-polymer		24.3	4	Chemie (MG)
3	D, I (A, B)	PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER	non-polymer		506.2	2	Chemie (ANP)
4	E, K (A, B)	MALONIC ACID	non-polymer		104.1	2	Chemie (MLA)
5	H, M (A, B)	N~2~-{(2R)-2-hydroxy-2-[4-(trifluoromethyl)phenyl]acetyl}-N-[(pyridin-2-yl)methyl]-L-cysteinamide	non-polymer		413.4	2	Chemie (R7D)
6	J (B)	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
7	N, O (A, B)	water	water		18.0	500	Chemie (HOH)

Sequence modifications

A, B: 7 - 20 (UniProt: Q9ULW0)

PDB	External Database	Details
Gly -4	-	expression tag
Ala -3	-	expression tag
His -2	-	expression tag
Met -1	-	expression tag

A, B: 116 - 389 (UniProt: O14965)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	67973.5
Non-Polymers*	Number of molecules	11
	Total formula weight	2236.7
All*	Total formula weight	70210.1

*Water molecules are not included.