Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9740bb64c2d53d412f622a5e60729345",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 20.720,
"b": 32.251,
"c": 37.941,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.61992],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.720,0.900],
"number_observations": 157929,
"number_observations_unique": 19493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [0.920,0.900],
"number_observations": 5903,
"number_observations_unique": 920,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.684
},
{
"type": "R(meas)",
"value": 1.835
},
{
"type": "R(pim)",
"value": 0.712
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.457
}
]
},
{
"resolution_limits": [20.720,4.930],
"number_observations": 983,
"number_observations_unique": 154,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 47.200
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}