5W4L
Crystal structure of the non-neutralizing and ADCC-potent C11-like antibody N12-i3 in complex with HIV-1 clade A/E gp120, the CD4 mimetic M48U1, and the antibody N5-i5.
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | G, A | clade A/E 93TH057 HIV-1 gp120 core | polymer | 385 | 42847.7 | 2 | UniProt (A0A0M3KKW9) Pfam (PF00516) In PDB | Human immunodeficiency virus 1 | |
2 | N, M | CD4 mimetic peptide M48U1 | polymer | 28 | 3056.8 | 2 | BIRD (PRD_001094) | synthetic construct | |
3 | H, F | Antibody N5-i5 Fab heavy chain | polymer | 226 | 23789.6 | 2 | Homo sapiens | ||
4 | L, I | Antibody N5-i5 light chain | polymer | 217 | 22943.2 | 2 | Homo sapiens | ||
5 | D, B | Antibody N12-i3 Fab heavy chain | polymer | 225 | 24170.0 | 2 | Homo sapiens | ||
6 | E, C | Antibody N12-i3 light chain | polymer | 215 | 23485.1 | 2 | Homo sapiens | ||
7 | A, G | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 21 | Chemie (NAG) | |||
8 | A, N | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
9 | water | water | 18.0 | 20 | Chemie (HOH) |
Sequence modifications
G, A: 44 - 492 (UniProt: A0A0M3KKW9)
PDB | External Database | Details |
---|---|---|
Ser 31 | - | see sequence details |
Asp 32 | - | see sequence details |
Asn 33 | - | see sequence details |
Leu 34 | - | see sequence details |
Trp 35 | - | see sequence details |
Val 36 | - | see sequence details |
Thr 37 | - | see sequence details |
Val 38 | - | see sequence details |
Tyr 39 | - | see sequence details |
Tyr 40 | - | see sequence details |
Gly 41 | - | see sequence details |
Val 42 | - | see sequence details |
Pro 43 | - | see sequence details |
Ser 375 | His 242 | engineered mutation |
Pro 493 | - | see sequence details |
Leu 494 | - | see sequence details |
Gly 495 | - | see sequence details |
Ile 496 | - | see sequence details |
Ala 497 | - | see sequence details |
Pro 498 | - | see sequence details |
Thr 499 | - | see sequence details |
Lys 500 | - | see sequence details |
Ala 501 | - | see sequence details |
Lys 502 | - | see sequence details |
Arg 503 | - | see sequence details |
Arg 504 | - | see sequence details |
Val 505 | - | see sequence details |
Val 506 | - | see sequence details |
Gln 507 | - | see sequence details |
Arg 508 | - | see sequence details |
Glu 509 | - | see sequence details |
Lys 510 | - | see sequence details |
Arg 511 | - | see sequence details |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 12 |
Total formula weight | 280584.9 | |
Non-Polymers* | Number of molecules | 23 |
Total formula weight | 4716.3 | |
All* | Total formula weight | 285301.2 |