Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "69a5ae2fa20911fcabcea6902fa916f4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.565,
"b": 94.414,
"c": 69.775,
"alpha": 90.00,
"beta": 112.79,
"gamma": 90.00
},
"wavelengths": [1.00000,1.03880,1.03110,1.03700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.300],
"number_observations_unique": 29404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07400
},
{
"type": "I/SigI",
"value": 27.7000
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.30],
"number_observations_unique": 2882,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.42500
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 3.90
}
]
}
]
}