6F6I
CRYSTAL STRUCTURE OF EBOLAVIRUS GLYCOPROTEIN IN COMPLEX WITH PAROXETINE
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Envelope glycoprotein,GP,GP1 | polymer | 330 | 36302.7 | 1 | UniProt (A0A0E3NBB1) UniProt (A0A0D5W976) Pfam (PF01611) UniProt (by SIFTS) (Q05320) In PDB | Ebola virus | |
2 | B | Envelope glycoprotein | polymer | 168 | 18922.3 | 1 | UniProt (A0A0U3BWW0) Pfam (PF22307) UniProt (by SIFTS) (Q05320) In PDB | Ebola virus | |
3 | C | alpha-D-mannopyranose-(1-6)-beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 748.7 | 1 | In PDB GlyTouCan (G22573RC) | |||
4 | A | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 4 | Chemie (NAG) | |||
5 | A | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) | |||
6 | A, B | GLYCEROL | non-polymer | 92.1 | 5 | Chemie (GOL) | |||
7 | A | Paroxetine | non-polymer | 329.4 | 1 | Chemie (8PR) | |||
8 | water | water | 18.0 | 103 | Chemie (HOH) |
Sequence modifications
A: 32 - 432 (UniProt: A0A0E3NBB1)
A: 433 - 470 (UniProt: A0A0D5W976)
A: 471 - 477 (PDB: 6F6I)
B: 502 - 632 (UniProt: A0A0U3BWW0)
PDB | External Database | Details |
---|---|---|
Glu 28 | - | expression tag |
Thr 29 | - | expression tag |
Gly 30 | - | expression tag |
Arg 31 | - | expression tag |
Ala 42 | Thr 42 | engineered mutation |
A: 471 - 477 (PDB: 6F6I)
B: 502 - 632 (UniProt: A0A0U3BWW0)
PDB | External Database | Details |
---|---|---|
Ala 613 | His 613 | engineered mutation |
Gly 633 | - | expression tag |
Ser 634 | - | expression tag |
Gly 635 | - | expression tag |
Tyr 636 | - | expression tag |
Ile 637 | - | expression tag |
Pro 638 | - | expression tag |
Glu 639 | - | expression tag |
Ala 640 | - | expression tag |
Pro 641 | - | expression tag |
Arg 642 | - | expression tag |
Asp 643 | - | expression tag |
Gly 644 | - | expression tag |
Gln 645 | - | expression tag |
Ala 646 | - | expression tag |
Tyr 647 | - | expression tag |
Val 648 | - | expression tag |
Arg 649 | - | expression tag |
Lys 650 | - | expression tag |
Asp 651 | - | expression tag |
Gly 652 | - | expression tag |
Glu 653 | - | expression tag |
Trp 654 | - | expression tag |
Val 655 | - | expression tag |
Leu 656 | - | expression tag |
Leu 657 | - | expression tag |
Ser 658 | - | expression tag |
Thr 659 | - | expression tag |
Phe 660 | - | expression tag |
Leu 661 | - | expression tag |
Gly 662 | - | expression tag |
Thr 663 | - | expression tag |
His 664 | - | expression tag |
His 665 | - | expression tag |
His 666 | - | expression tag |
His 667 | - | expression tag |
His 668 | - | expression tag |
His 669 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 55225.0 | |
Branched | Number of molecules | 1 |
Total formula weight | 748.7 | |
Non-Polymers* | Number of molecules | 11 |
Total formula weight | 1752.8 | |
All* | Total formula weight | 57726.5 |