MolNFT v1 · #148927 · protein

Crystal structure of the membrane attack complex assembly inhibitor BGA71 from lyme disease agent borreliella bavariensis

6FL0: “Crystal structure of the membrane attack complex assembly inhibitor BGA71 from lyme disease agent borreliella…”. X-ray diffraction, 20 pockets (best druggability 0.80). MolNFT v1 #148927 on GenesisL1: 3D structure, binding sites and…

PDB: 6FL0
Type: protein
Length: 3,162 residues
Chains: 18
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Membrane attack complex assembly inhibitor BGA71
UniProt: Q6ASF4
Pockets: 20 · best druggability 0.80

Structure

x-ray diffraction · 14 distinct chains · 78% helix, 0% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A, D	Membrane attack complex assembly inhibitor BGA71	protein	183	79% helix, 0% strand	Q6ASF4
B	Membrane attack complex assembly inhibitor BGA71	protein	170	76% helix, 0% strand	Q6ASF4
C, J, L	Membrane attack complex assembly inhibitor BGA71	protein	181	79% helix, 0% strand	Q6ASF4
E, O	Membrane attack complex assembly inhibitor BGA71	protein	183	78% helix, 0% strand	Q6ASF4
F	Membrane attack complex assembly inhibitor BGA71	protein	173	77% helix, 0% strand	Q6ASF4
G	Membrane attack complex assembly inhibitor BGA71	protein	170	79% helix, 0% strand	Q6ASF4
H	Membrane attack complex assembly inhibitor BGA71	protein	173	79% helix, 0% strand	Q6ASF4
I	Membrane attack complex assembly inhibitor BGA71	protein	181	77% helix, 0% strand	Q6ASF4
K	Membrane attack complex assembly inhibitor BGA71	protein	158	78% helix, 0% strand	Q6ASF4
M	Membrane attack complex assembly inhibitor BGA71	protein	171	79% helix, 0% strand	Q6ASF4
N	Membrane attack complex assembly inhibitor BGA71	protein	172	79% helix, 0% strand	Q6ASF4
P	Membrane attack complex assembly inhibitor BGA71	protein	178	79% helix, 0% strand	Q6ASF4
Q	Membrane attack complex assembly inhibitor BGA71	protein	175	79% helix, 0% strand	Q6ASF4
R	Membrane attack complex assembly inhibitor BGA71	protein	166	81% helix, 0% strand	Q6ASF4

Pockets

20 pockets found on a 1 Å grid, 19 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	618	0.80	0.85	65	empty
2	625	0.80	0.85	58	empty
3	587	0.80	0.85	58	empty
4	458	0.80	0.87	49	empty
5	594	0.79	0.85	70	empty

Interfaces

34 interfaces between chains.

F–O · 1205 Å² buried · 6 hydrogen bonds · protein-protein
J–P · 1174 Å² buried · 7 hydrogen bonds · protein-protein
I–N · 1132 Å² buried · 8 hydrogen bonds · protein-protein
A–G · 1110 Å² buried · 8 hydrogen bonds · protein-protein
L–Q · 433 Å² buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

6FL0 · Crystal structure of the membrane attack complex assembly inhibitor BGA71 from Lyme… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt Q6ASF4
Elsewhere: RCSB PDB 6FL0 · PDBe 6FL0 · UniProt Q6ASF4

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.