8JY6

Structure of TbAQP2 in complex with anti-trypanosomatid drug melarsoprol

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D (A, B, C, D)	Aquaglyceroporin 2	polymer	343	36775.9	4	UniProt (Q6ZXT3)	Trypanosoma brucei brucei
2	E, F, G, H (A, B, C, D)	[(4~{R})-2-[4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]amino]phenyl]-1,3,2-dithiarsolan-4-yl]methanol	non-polymer		398.3	4	Chemie (L1U)

Sequence modifications

A, B, C, D: 1 - 312 (UniProt: Q6ZXT3)

PDB	External Database	Details
Ser 313	-	expression tag
Asn 314	-	expression tag
Ser 315	-	expression tag
Trp 316	-	expression tag
Ser 317	-	expression tag
His 318	-	expression tag
Pro 319	-	expression tag
Gln 320	-	expression tag
Phe 321	-	expression tag
Glu 322	-	expression tag
Lys 323	-	expression tag
Gly 324	-	expression tag
Gly 325	-	expression tag
Gly 326	-	expression tag
Ser 327	-	expression tag
Gly 328	-	expression tag
Gly 329	-	expression tag
Gly 330	-	expression tag
Ser 331	-	expression tag
Gly 332	-	expression tag
Gly 333	-	expression tag
Ser 334	-	expression tag
Ala 335	-	expression tag
Trp 336	-	expression tag
Ser 337	-	expression tag
His 338	-	expression tag
Pro 339	-	expression tag
Gln 340	-	expression tag
Phe 341	-	expression tag
Glu 342	-	expression tag
Lys 343	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	147103.7
Non-Polymers*	Number of molecules	4
	Total formula weight	1593.4
All*	Total formula weight	148697.0

*Water molecules are not included.