Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e2635ea0193dfd9eecc541b50d72591",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 97.963,
"b": 97.963,
"c": 164.312,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.000,2.200],
"number_observations_unique": 41184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 11.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.20],
"number_observations_unique": 4044,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.243
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 9.40
}
]
},
{
"resolution_limits": [2.37,2.28],
"number_observations_unique": 4026,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 10.00
}
]
},
{
"resolution_limits": [2.48,2.37],
"number_observations_unique": 4082,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 10.40
}
]
},
{
"resolution_limits": [2.61,2.48],
"number_observations_unique": 4062,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.198
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 10.80
}
]
},
{
"resolution_limits": [2.77,2.61],
"number_observations_unique": 4088,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 11.30
}
]
},
{
"resolution_limits": [2.98,2.77],
"number_observations_unique": 4093,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 11.70
}
]
},
{
"resolution_limits": [3.28,2.98],
"number_observations_unique": 4114,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 12.00
}
]
},
{
"resolution_limits": [3.76,3.28],
"number_observations_unique": 4148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 12.30
}
]
},
{
"resolution_limits": [4.72,3.76],
"number_observations_unique": 4167,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 12.20
}
]
},
{
"resolution_limits": [20.00,4.72],
"number_observations_unique": 4360,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "Completeness",
"value": 98.20
},
{
"type": "Redundancy",
"value": 12.20
}
]
}
]
}