Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "73bc9bbe0086116e46e0782246536627",
"space_group_name": "P 61",
"unit_cell": {
"a": 34.891,
"b": 34.891,
"c": 210.047,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.010,1.350],
"number_observations": 545282,
"number_observations_unique": 31687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.249
},
{
"type": "R(meas)",
"value": 0.257
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.370,1.350],
"number_observations": 14540,
"number_observations_unique": 1539,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.832
},
{
"type": "R(meas)",
"value": 4.041
},
{
"type": "R(pim)",
"value": 1.253
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.426
}
]
},
{
"resolution_limits": [35.010,7.390],
"number_observations": 4122,
"number_observations_unique": 216,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 43.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}