Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ef849b6ecb0e2fb9cdea6c9bec4293a2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 117.780,
"b": 64.362,
"c": 74.499,
"alpha": 90.00,
"beta": 125.82,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.750,1.960],
"number_observations": 132959,
"number_observations_unique": 32239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.010,1.960],
"number_observations": 8988,
"number_observations_unique": 2206,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.691
},
{
"type": "R(meas)",
"value": 0.794
},
{
"type": "R(pim)",
"value": 0.386
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.820
}
]
},
{
"resolution_limits": [34.750,8.980],
"number_observations": 1290,
"number_observations_unique": 351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 24.700
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}