Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2a5653deb3124c956fb1a1da3fe19db",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 94.554,
"b": 133.505,
"c": 81.753,
"alpha": 90.00,
"beta": 125.27,
"gamma": 90.00
},
"wavelengths": [0.97951],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.28,2.3],
"number_observations_unique": 36727,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "R(meas)",
"value": 0.201
},
{
"type": "R(pim)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 8.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 9.8
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.30],
"number_observations_unique": 3590,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.330
},
{
"type": "R(pim)",
"value": 0.679
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.762
}
]
}
]
}