6QTL

Deposited: 2019-02-25 Released: 2019-04-10
Deposition Author(s): Lesne, J., Guichou, J.F., Labesse, G., Cohen-Gonsaud, M.

Experimental Data Snapshot

Starting Model: experimental
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wwPDB Validation 3D Report Full Report

Ligand Structure Quality Assessment

This is version 1.1 of the entry. See complete history.

Literature

Lesne, J.x.

To be published.

Macromolecule Content

Macromolecules

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(by identity cutoff) | 3D Structure

Entity ID: 1
Molecule	Chains	Sequence Length	Organism	Details	Image
VHH	A [auth H], B [auth A], E [auth D], F [auth E]	119	Camelidae	Mutation(s): 0
Entity Groups
Sequence Clusters	30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
Sequence Annotations Expand
Reference Sequence

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(by identity cutoff) | 3D Structure

Entity ID: 2
Molecule	Chains	Sequence Length	Organism	Details	Image
VHH	C [auth B], D [auth C], G [auth F], H [auth G]	120	Camelidae	Mutation(s): 0
Entity Groups
Sequence Clusters	30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
Sequence Annotations Expand
Reference Sequence

Small Molecules

Ligands 1 Unique
ID	Chains	Name / Formula / InChI Key	2D Diagram	3D Interactions
CFF Query on CFF Download Ideal Coordinates CCD File SDF format, chain I [auth H] SDF format, chain J [auth A] SDF format, chain K [auth D] SDF format, chain L [auth E] MOL2 format, chain I [auth H] MOL2 format, chain J [auth A] MOL2 format, chain K [auth D] MOL2 format, chain L [auth E] mmCIF format, chain I [auth H] mmCIF format, chain J [auth A] mmCIF format, chain K [auth D] mmCIF format, chain L [auth E]	I [auth H], J [auth A], K [auth D], L [auth E]	CAFFEINE C₈ H₁₀ N₄ O₂ RYYVLZVUVIJVGH-UHFFFAOYSA-N		Interactions Focus chain I [auth H] Focus chain J [auth A] Focus chain K [auth D] Focus chain L [auth E] Interactions & Density Focus chain I [auth H] Focus chain J [auth A] Focus chain K [auth D] Focus chain L [auth E]