Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ff2c29ec89418aa6d80b1379352d1b39",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 29.787,
"b": 34.841,
"c": 81.604,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.802,1.402],
"number_observations_unique": 17334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 21.58
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.69
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.49,1.402],
"number_observations_unique": 5196,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.282
},
{
"type": "I/SigI",
"value": 1.34
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.16
},
{
"type": "CC(1/2)",
"value": 0.632
}
]
},
{
"resolution_limits": [1.59,1.49],
"number_observations_unique": 2872,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.682
},
{
"type": "I/SigI",
"value": 2.67
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.57
},
{
"type": "CC(1/2)",
"value": 0.86
}
]
}
]
}