Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2b748c47e055983df0c86e6d0b966f49",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 69.73,
"b": 71.04,
"c": 71.79,
"alpha": 90.00,
"beta": 99.52,
"gamma": 90.00
},
"wavelengths": [1.54187],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.801,1.793],
"number_observations_unique": 31221,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.793],
"number_observations_unique": 4321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.315
},
{
"type": "R(meas)",
"value": 0.391
},
{
"type": "R(pim)",
"value": 0.226
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 2.500
}
]
},
{
"resolution_limits": [2.000,1.890],
"number_observations_unique": 4476,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "R(meas)",
"value": 0.251
},
{
"type": "R(pim)",
"value": 0.143
},
{
"type": "I/SigI",
"value": 3.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 2.600
}
]
},
{
"resolution_limits": [2.140,2.000],
"number_observations_unique": 4161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.179
},
{
"type": "R(pim)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [2.310,2.140],
"number_observations_unique": 3867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(meas)",
"value": 0.136
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 2.700
}
]
},
{
"resolution_limits": [2.540,2.310],
"number_observations_unique": 3499,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 2.800
}
]
},
{
"resolution_limits": [2.840,2.540],
"number_observations_unique": 3154,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 9.900
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [3.270,2.840],
"number_observations_unique": 2751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 11.300
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [4.010,3.270],
"number_observations_unique": 2287,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 12.100
},
{
"type": "Completeness",
"value": 93.700
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [5.670,4.010],
"number_observations_unique": 1761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 15.800
},
{
"type": "Completeness",
"value": 92.400
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [42.987,5.670],
"number_observations_unique": 944,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 20.900
},
{
"type": "Completeness",
"value": 88.700
},
{
"type": "Redundancy",
"value": 3.100
}
]
}
]
}