Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7926c4da4629735536f91ba1a934a65b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 102.176,
"b": 105.358,
"c": 297.809,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [148.900,1.960],
"number_observations": 705096,
"number_observations_unique": 225895,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.990,1.960],
"number_observations": 35457,
"number_observations_unique": 11236,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.800
},
{
"type": "R(meas)",
"value": 2.164
},
{
"type": "R(pim)",
"value": 1.179
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.292
}
]
},
{
"resolution_limits": [148.900,10.740],
"number_observations": 4706,
"number_observations_unique": 1514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 24.400
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}