5FCU

CRYSTAL STRUCTURE OF THE INNER DOMAIN OF CLADE A/E HIV-1 GP120 IN COMPLEX WITH THE ADCC-POTENT RHESUS MACAQUE ANTIBODY JR4

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (G)	clade A/E 93TH057 HIV-1 gp120 core	polymer	169	18802.3	1	UniProt (A0A0M3KKW9) Pfam (PF00516)	Human immunodeficiency virus 1
2	B (H)	JR4 FAB HEAVY CHAIN	polymer	233	24847.8	1		Macaca mulatta (RHESUS MACAQUE)
3	C (L)	JR4 FAB LIGHT CHAIN	polymer	216	22719.1	1		Macaca mulatta (RHESUS MACAQUE)
4	D (G)	2-acetamido-2-deoxy-beta-D-glucopyranose	non-polymer		221.2	1	Chemie (NAG)
5	E, F, G (L)	SULFATE ION	non-polymer		96.1	3	Chemie (SO4)
6	H, I, J (L)	CHLORIDE ION	non-polymer		35.5	3	Chemie (CL)
7	K, L, M (G, H, L)	water	water		18.0	376	Chemie (HOH)

Sequence modifications

G: 44 - 469 (UniProt: A0A0M3KKW9)

PDB	External Database	Details
Val 42	-	expression tag
Pro 43	-	expression tag
Ser 470	-	expression tag
Gly 471	-	expression tag
Gly 472	-	expression tag
Gly 473	-	expression tag
Asn 474	-	expression tag
Ile 475	-	expression tag
Lys 476	-	expression tag
Asp 477	-	expression tag
Asn 478	-	expression tag
Trp 479	-	expression tag
Arg 480	-	expression tag
Ser 481	-	expression tag
Glu 482	-	expression tag
Leu 483	-	expression tag
Tyr 484	-	expression tag
Lys 485	-	expression tag
Tyr 486	-	expression tag
Lys 487	-	expression tag
Val 488	-	expression tag
Val 489	-	expression tag
Gln 490	-	expression tag
Ile 491	-	expression tag
Glu 492	-	expression tag
Pro 493	-	expression tag
Leu 494	-	expression tag
Gly 495	-	expression tag
Ile 496	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	3
	Total formula weight	66369.3
Non-Polymers*	Number of molecules	7
	Total formula weight	615.8
All*	Total formula weight	66985.0

*Water molecules are not included.