Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fd45c03458d208224de7f25759449bb7",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 117.807,
"b": 64.564,
"c": 74.264,
"alpha": 90.00,
"beta": 125.92,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.700,2.370],
"number_observations": 74832,
"number_observations_unique": 18184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.370],
"number_observations": 7289,
"number_observations_unique": 1796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.695
},
{
"type": "R(meas)",
"value": 0.800
},
{
"type": "R(pim)",
"value": 0.391
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 92.700
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.799
}
]
},
{
"resolution_limits": [47.700,8.850],
"number_observations": 1387,
"number_observations_unique": 364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}